SCHEMBL19951493

SCHEMBL19951493

O=c1[nH]nc(N2CCN(c3ccc(Cl)cc3)CC2)c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.51
▸ ALDH1A1 P00352 4/20 0.51
▸ TSHR P16473 3/20 0.51
▸ HPGD P15428 2/20 0.51
▸ PARP1 P09874 2/20 0.51
▸ ENPP1 P22413 1/20 0.48
▸ HTR1A P08908 2/20 0.47
▸ HTR7 P34969 2/20 0.47
▸ TP53 P04637 1/20 0.47
▸ KMT2A Q03164 1/20 0.46
▸ DRD4 P21917 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ DRD2 P14416 2/20 0.45
▸ DRD3 P35462 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ GPR84 Q9NQS5 1/20 0.45

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
SCHEMBL30418223 1.00 LMNA (0.51) LMNAALDH1A1TSHRHPGDPARP1
SCHEMBL30417899 0.88 TSHR (0.63) LMNAALDH1A1TSHRHPGDPARP1
SCHEMBL19951504 0.88 TSHR (0.63) LMNAALDH1A1TSHRHPGDPARP1
SCHEMBL13721430 0.80 PARP1 (0.53) LMNAALDH1A1TSHRHPGDPARP1
SCHEMBL13720770 0.80 HTR3A (0.53) LMNAALDH1A1TSHRHPGDPARP1
SCHEMBL831675 0.78 ENPP1 (0.53) LMNAALDH1A1TSHRHPGDPARP1
SCHEMBL29688141 0.78 ENPP1 (0.53) LMNAALDH1A1TSHRHPGDPARP1
SCHEMBL13720391 0.78 ALDH1A1 (0.60) LMNAALDH1A1HPGDPARP1ENPP1
SCHEMBL6373163 0.77 PARP1 (0.70) LMNAPARP1HTR1AHTR7DRD4
SCHEMBL13720327 0.77 ENPP1 (0.55) LMNAALDH1A1TSHRHPGDPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11446274-B2 Use of dianhydrogalactitol or derivatives or analogs thereof for treatment of pediatric central nervous system malignancies DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2022-09-20 — — US disclosed
US-20190183843-A9 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DELMAR PHARMACEUTICALS, INC. (CA) 2019-06-20 — — US disclosed
US-20190175541-A1 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DELMAR PHARMACEUTICALS, INC. (CA) 2019-06-13 — — US disclosed
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 disclosed
US-20180071244-A1 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DELMAR PHARMACEUTICALS INC (CA) 2018-03-15 — — 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 (5 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-20190175541-A1 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DCK, CDC7, DNMT1 LMNA 4638/4885ALDH1A1 2337/4885TSHR 4077/4885
US-11446274-B2 Use of dianhydrogalactitol or derivatives or analogs thereof for treatment of pediatric central nervous system malignancies DCK, CDC7, DNMT1 LMNA 4638/4885ALDH1A1 2337/4885TSHR 4077/4885
US-20180071244-A1 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DCK, CDC7, DNMT1 LMNA 4638/4885ALDH1A1 2337/4885TSHR 4077/4885
US-20190183843-A9 USE OF DIANHYDROGALACTITOL OR DERIVATIVES OR ANALOGS THEREOF FOR TREATMENT OF PEDIATRIC CENTRAL NERVOUS SYSTEM MALIGNANCIES DCK, CDC7, DNMT1 LMNA 4638/4885ALDH1A1 2337/4885TSHR 4077/4885
US-20190091195-A1 USE OF DIANHYDROGALACTITOL AND DERIVATIVES THEREOF IN THE TREATMENT OF GLIOBLASTOMA, LUNG CANCER, AND OVARIAN CANCER DDOST, DCLRE1A, OGG1 LMNA 1414/4885ALDH1A1 2307/4885TSHR 4615/4885

“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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