SCHEMBL13559495

SCHEMBL13559495

Cc1ccccc1CN1C2=NCCN2C(=O)C2=C1CCN(Cc1ccccc1)C2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 1.00
▸ SMN1; SMN2 Q16637 1/20 1.00
▸ HIF1A Q16665 1/20 1.00
▸ CLPP Q16740 10/20 0.87
▸ GPR132 Q9UNW8 2/20 0.87
▸ CYP2D6 P10635 1/20 0.87
▸ DRD2 P14416 1/20 0.87
▸ DRD3 P35462 1/20 0.87
▸ KCNH2 Q12809 1/20 0.87
▸ HDAC1 Q13547 4/20 0.62
▸ HDAC3 O15379 1/20 0.50
▸ HDAC2 Q92769 1/20 0.50
▸ NCOR2 Q9Y618 1/20 0.50
▸ GAA P10253 1/20 0.42
▸ GFER P55789 1/20 0.42
▸ TSHR P16473 1/20 0.41
▸ SOS1 Q07889 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30085760 1.00 CYP3A4 (1.00) CYP3A4SMN1; SMN2HIF1ACLPPGPR132
Dordaviprone SCHEMBL16227974 0.93 CLPP (1.00) CYP3A4SMN1; SMN2HIF1ACLPPGPR132
Dordaviprone SCHEMBL29359574 0.93 CLPP (1.00) CYP3A4SMN1; SMN2HIF1ACLPPGPR132
Dordaviprone SCHEMBL29414943 0.92 CLPP (0.98) CYP3A4SMN1; SMN2HIF1ACLPPGPR132
Dordaviprone SCHEMBL31548590 0.92 CLPP (0.98) CYP3A4SMN1; SMN2HIF1ACLPPGPR132
SCHEMBL22065223 0.88 CYP3A4 (0.79) CYP3A4SMN1; SMN2HIF1ACLPPGPR132
SCHEMBL20173633 0.87 CLPP (0.89) CYP3A4SMN1; SMN2HIF1ACLPPGPR132
SCHEMBL18427332 0.87 CYP3A4 (0.77) CYP3A4SMN1; SMN2HIF1ACLPPGPR132
SCHEMBL18254945 0.87 CLPP (0.85) CYP3A4SMN1; SMN2HIF1ACLPPGPR132
SCHEMBL18254991 0.87 CLPP (0.89) CYP3A4SMN1; SMN2HIF1ACLPPGPR132

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 80 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190091195-A1 USE OF DIANHYDROGALACTITOL AND DERIVATIVES THEREOF IN THE TREATMENT OF GLIOBLASTOMA, LUNG CANCER, AND OVARIAN CANCER DEL MAR PHARMACEUTICALS (CA) 2019-03-28 — — US claimed
US-20180369264-A1 COMBINATION OF A CARDIAC STEROID AND AN AKT INHIBITOR FOR THE TREATMENT OF CARDIOVASCULAR DISEASES AND DISORDERS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2018-12-27 — — US claimed
EP-3393477-A1 COMBINATION OF A CARDIAC STEROID AND AN AKT INHIBITOR FOR THE TREATMENT OF CARDIOVASCULAR DISEASES AND DISORDERS Yissum Research and Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2018-10-31 — — EP claimed
WO-2017109778-A1 COMBINATION OF A CARDIAC STEROID AND AN AKT INHIBITOR FOR THE TREATMENT OF CARDIOVASCULAR DISEASES AND DISORDERS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2017-06-29 — — WO claimed
WO-2017042634-A2 USE OF DIANHYDROGALACTITOL OR DERIVATIVES AND ANALOGS THEREOF FOR TREATMENT OF NON-SMALL-CELL LUNG CARCINOMA, GLIOBLASTOMA, AND OVARIAN CARCINOMA BY INDUCTION OF DNA DAMAGE AND STALLING OF CELL CYCLE DEL MAR PHARMACEUTICALS (CA) 2017-03-16 — — WO claimed
US-12630550-B2 Pharmacophore for trail induction THE SCRIPPS RESEARCH INSTITUTE (US) 2026-05-19 — — US disclosed
EP-4706682-A2 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY The Penn State Research Foundation (US) 2026-03-11 — — EP disclosed
US-20240415841-A1 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY THE PENN STATE RESEARCH FOUNDATION (US) 2024-12-19 — — US disclosed
EP-4470617-A2 PHARMACOPHORE FOR TRAIL INDUCTION The Scripps Research Institute (US) 2024-12-04 — — EP disclosed
EP-3662910-B1 PHARMACOPHORE FOR TRAIL INDUCTION SCRIPPS RESEARCH INST (US) 2024-09-18 — — EP disclosed
US-12036223-B2 Small molecule trail gene induction by normal and tumor cells as an anticancer therapy THE PENN STATE RESEARCH FOUNDATION (US) 2024-07-16 — — US disclosed
US-20240190877-A1 PHARMACOPHORE FOR TRAIL INDUCTION THE SCRIPPS RESEARCH INSTITUTE 2024-06-13 — — US disclosed
US-20140271540-A1 7-benzyl-10-(2-methylbenzyl)-2,6,7,8,9,10-hexahydroimidazo[1,2-a]pyrido[4,3-d]pyrimidin-5(3H)-one, Salts thereof And Methods of Using The Same in Combination Therapy ONCOCEUTICS, INC. (US) 2014-09-18 — — US disclosed
US-20140248264-A1 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY THE PENN STATE RESEARCH FOUNDATION (US) 2014-09-04 — — US disclosed
US-20140248264-A1 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY THE PENN STATE RESEARCH FOUNDATION (US) 2014-09-04 — — US disclosed
US-8673923-B2 Small molecule trail gene induction by normal and tumor cells as an anticancer therapy THE PENN STATE RESEARCH FOUNDATION (US) 2014-03-18 — — US disclosed
US-8673923-B2 Small molecule trail gene induction by normal and tumor cells as an anticancer therapy THE PENN STATE RESEARCH FOUNDATION (US) 2014-03-18 — — US disclosed
WO-2012149546-A2 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY THE PENN STATE RESEARCH FOUNDATION (US) 2012-11-01 — — WO disclosed
US-20120276088-A1 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY THE PENN STATE RESEARCH FOUNDATION (US) 2012-11-01 — — US disclosed
US-20120276088-A1 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY THE PENN STATE RESEARCH FOUNDATION (US) 2012-11-01 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12036223-B2 Small molecule trail gene induction by normal and tumor cells as an anticancer therapy TSG101, TNFSF10, BCL2L10 CYP3A4 4677/4885SMN1; SMN2 1225/4885HIF1A 3479/4885
US-12630550-B2 Pharmacophore for trail induction STAT3, STAT1, STAT4 CYP3A4 218/4885SMN1; SMN2 3993/4885HIF1A 3416/4885
US-20140248264-A1 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY TSG101, TNFSF10, BCL2L10 CYP3A4 4677/4885SMN1; SMN2 1225/4885HIF1A 3479/4885
US-20240415841-A1 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY TSG101, TNFSF10, BCL2L10 CYP3A4 4677/4885SMN1; SMN2 1225/4885HIF1A 3479/4885
US-20120276088-A1 SMALL MOLECULE TRAIL GENE INDUCTION BY NORMAL AND TUMOR CELLS AS AN ANTICANCER THERAPY TSG101, TNFSF10, BCL2L10 CYP3A4 4677/4885SMN1; SMN2 1225/4885HIF1A 3479/4885
US-20190091195-A1 USE OF DIANHYDROGALACTITOL AND DERIVATIVES THEREOF IN THE TREATMENT OF GLIOBLASTOMA, LUNG CANCER, AND OVARIAN CANCER DDOST, DCLRE1A, OGG1 CYP3A4 3533/4885SMN1; SMN2 2556/4885HIF1A 2435/4885
US-20140271540-A1 7-benzyl-10-(2-methylbenzyl)-2,6,7,8,9,10-hexahydroimidazo[1,2-a]pyrido[4,3-d]pyrimidin-5(3H)-one, Salts thereof And Methods of Using The Same in Combination Therapy PAICS, TPMT, THPO CYP3A4 3739/4885SMN1; SMN2 11/4885HIF1A 2621/4885
US-20240190877-A1 PHARMACOPHORE FOR TRAIL INDUCTION AIFM1, TNFRSF1A, TNFSF10 CYP3A4 205/4885SMN1; SMN2 3880/4885HIF1A 2194/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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