SCHEMBL10957697

SCHEMBL10957697

Cc1ncnc(Nc2ccc(F)cc2)c1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.59
TDP1 Q9NUW8 3/20 0.57
KMT2A Q03164 2/20 0.50
MKNK1 Q9BUB5 2/20 0.50
RAB9A P51151 1/20 0.50
MEN1 O00255 1/20 0.50
MKNK2 Q9HBH9 1/20 0.50
ERBB2 P04626 1/20 0.49
CYP1A2 P05177 3/20 0.49
CYP3A4 P08684 3/20 0.49
CYP2D6 P10635 3/20 0.49
CYP2C19 P33261 3/20 0.49
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 1/20 0.49
TSHR P16473 1/20 0.49
LMNA P02545 2/20 0.46
USP2 O75604 1/20 0.46
TP53 P04637 1/20 0.46
HIF1A Q16665 1/20 0.46

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
SCHEMBL10955530 0.85 EGFR (0.57) EGFRRAB9AERBB2ALDH1A1MAPT
SCHEMBL11010395 0.82 CCNT1 (0.50) EGFRTDP1KMT2ARAB9AMEN1
SCHEMBL10955745 0.82 TTBK1 (0.51) EGFRKMT2AMKNK1RAB9AMEN1
SCHEMBL10956277 0.82 EGFR (0.50) EGFRKMT2AMKNK1RAB9AMEN1
SCHEMBL10958226 0.81 EGFR (0.57) EGFRRAB9AERBB2CYP1A2CYP3A4
SCHEMBL10952199 0.81 DHODH (0.59) EGFRDHODHTTBK1
SCHEMBL10955619 0.80 TDP1 (0.52) EGFRTDP1KMT2AMKNK1RAB9A
Hydrochloric Acid SCHEMBL10960314 0.80 EGFR (0.55) EGFRRAB9AERBB2CYP1A2CYP3A4
SCHEMBL10960003 0.79 NPC1 (0.46) EGFRTDP1KMT2ARAB9AMEN1
SCHEMBL10958170 0.79 MAPT (0.57) EGFRTDP1KMT2ARAB9AMEN1

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
CN-105669642-A Revaprzan hydrochloride preparation method 江苏天士力帝益药业有限公司 2016-06-15 CN claimed
CN-105669642-A Revaprzan hydrochloride preparation method 江苏天士力帝益药业有限公司 2016-06-15 CN disclosed
EP-0067630-B1 PYRIMIDINE DERIVATIVES, A PROCESS FOR PREPARING THEM AND A PHARMACEUTICAL COMPOSITION CONTAINING THEM SANKYO COMPANY LIMITED (JP) 1985-05-08 EP disclosed
US-4450162-A Pyrimidine derivatives and a pharmaceutical composition containing them SANKYO COMPANY, LIMITED (JP) 1984-05-22 US disclosed
EP-0067630-A1 Pyrimidine derivatives, a process for preparing them and a pharmaceutical composition containing them SANKYO COMPANY LIMITED (JP) 1982-12-22 EP disclosed