SCHEMBL7989907

SCHEMBL7989907

CCOc1ccc2ncn(-c3ccccc3)c2c1

nearest known ligand 0.79

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.74
ALDH1A1 P00352 1/20 0.74
HPGD P15428 1/20 0.74
MAPK1 P28482 1/20 0.74
MAPK10 P53779 1/20 0.74
NCOA1 Q15788 1/20 0.74
NCOA3 Q9Y6Q9 1/20 0.74
FGFR1 P11362 11/20 0.63
CYP1A2 P05177 1/20 0.62
PDE10A Q9Y233 1/20 0.62
SRC P12931 4/20 0.55

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
SCHEMBL7986395 0.88 FGFR1 (0.80) FGFR1SRC
Hydrochloric Acid SCHEMBL7975633 0.87 FGFR1 (0.78) FGFR1SRC
SCHEMBL3063006 0.85 HTT (1.00) HTTALDH1A1HPGDMAPK1MAPK10
SCHEMBL24297752 0.82 FGFR1 (0.74) HTTALDH1A1HPGDMAPK1MAPK10
SCHEMBL1150276 0.78 HPGD (0.49) HTTALDH1A1HPGDMAPK1MAPK10
SCHEMBL7993339 0.77 FGFR1 (1.00) FGFR1SRC
SCHEMBL7992992 0.77 FGFR1 (1.00) FGFR1SRC
SCHEMBL13993884 0.76 FGFR1 (0.76) HTTALDH1A1HPGDMAPK1MAPK10
Hydrochloric Acid SCHEMBL7986675 0.76 FGFR1 (0.97) FGFR1SRC
Hydrochloric Acid SCHEMBL7989591 0.76 FGFR1 (0.97) FGFR1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6218388-B1 THERAPY OF PROTEIN TYROSINE KINASE MEDIATED CANCER, ATHEROSCLEROSIS, RESTENOSIS, AND PSORIASIS BY ADMINISTERING BENZIMIDAZOLE DERIVATIVE WARNER-LAMBERT COMPANY 2001-04-17 US disclosed
US-5990146-A TREATING PROTEIN TYROSINE KINASE MEDIATED CANCER; ANTICARCINOGENIC AGENTS; ATHEROSCLEROSIS; RESTENOSIS; PSORIASIS; ANTIPROLIFERATIVE AGENTS WARNER-LAMBERT COMPANY (US) 1999-11-23 US disclosed