SCHEMBL22015318

SCHEMBL22015318

CC(C)(C)OC(=O)N1C[C@@H]2CN(c3ccc(Br)cc3)C[C@@H]2C1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.52
KCNK3 O14649 1/20 0.48
KCNK9 Q9NPC2 1/20 0.48
RORC P51449 2/20 0.47
FPR2 P25090 2/20 0.47
NR1H2 P55055 1/20 0.47
FPR3 P25089 1/20 0.47
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
ESRRB O95718 1/20 0.46
ESR1 P03372 1/20 0.46
ESRRA P11474 1/20 0.46
ESRRG P62508 1/20 0.46
USP30 Q70CQ3 1/20 0.46
LIPE Q05469 1/20 0.44
PDE10A Q9Y233 2/20 0.42

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
SCHEMBL927555 1.00 GPR119 (0.52) GPR119KCNK3KCNK9RORCFPR2
SCHEMBL20511076 0.87 GPR119 (0.67) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL27399965 0.87 GPR119 (0.67) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL31288397 0.86 HDAC1 (0.55) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL29723219 0.86 GPR119 (0.52) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL17135075 0.86 HDAC1 (0.55) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL22523841 0.86 GPR119 (0.52) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL12005457 0.86 GPR119 (0.52) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL31288417 0.86 HDAC1 (0.55) GPR119NR1H2ALDH1A1LMNAMAPT
SCHEMBL10111733 0.86 GPR119 (0.67) GPR119RORCNR1H2USP30PDE10A

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479849-B2 EGFR inhibitors for the treatment of cancer HOFFMANN-LA ROCHE INC. (US) 2025-11-25 US disclosed
CN-113993872-B EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2024-09-24 CN disclosed
US-12018029-B2 Hexahydropyrrolo[3,4-c]pyrrole derivatives useful as LOX inhibitors THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2024-06-25 US disclosed
US-12018029-B2 Hexahydropyrrolo[3,4-c]pyrrole derivatives useful as LOX inhibitors THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2024-06-25 US disclosed
US-20240018154-A1 NEW INDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-18 US disclosed
US-20240018154-A1 NEW INDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-18 US disclosed
US-20240018154-A1 NEW INDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2024-01-18 US disclosed
EP-4255906-A1 NEW INDAZOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2023-10-11 EP disclosed
US-20230054473-A1 EGFR INHIBITORS FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2023-02-23 US disclosed
WO-2022117487-A1 NEW INDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2022-06-09 WO disclosed
WO-2022117487-A1 NEW INDAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2022-06-09 WO disclosed
EP-3986896-A1 EGFR INHIBITORS FOR THE TREATMENT OF CANCER F. Hoffmann-La Roche AG (CH) 2022-04-27 EP disclosed
CN-113993872-A EGFR inhibitors for the treatment of cancer 豪夫迈·罗氏有限公司 2022-01-28 CN disclosed
WO-2020099886-A1 LOX INHIBITORS THE INSTITUTE OF CANCER RESEARCH: ROYAL CANCER HOSPITAL (GB) 2020-05-22 WO 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 (4 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-20240018154-A1 NEW INDAZOLE DERIVATIVES CYP3A43, CYP3A4, CYP3A5 GPR119 119/4885KCNK3 390/4885KCNK9 1092/4885
US-12018029-B2 Hexahydropyrrolo[3,4-c]pyrrole derivatives useful as LOX inhibitors LOX, LOXL1, LOXL3 GPR119 2107/4885KCNK3 3300/4885KCNK9 4278/4885
US-20230054473-A1 EGFR INHIBITORS FOR THE TREATMENT OF CANCER EGFR, ERBB2, ERBB3 GPR119 475/4885KCNK3 1938/4885KCNK9 1896/4885
US-12479849-B2 EGFR inhibitors for the treatment of cancer EGFR, ERBB2, ERBB3 GPR119 656/4885KCNK3 1630/4885KCNK9 1876/4885

“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.