SCHEMBL10790632

SCHEMBL10790632

Cc1cccc(C(O)c2nccn2Cc2ccc(Cl)cc2)c1C

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.56
LMNA P02545 3/20 0.48
KMT2A Q03164 3/20 0.47
CYP2D6 P10635 3/20 0.46
CYP2C19 P33261 3/20 0.46
CYP1A2 P05177 2/20 0.46
ALDH1A1 P00352 2/20 0.45
MAPT P10636 1/20 0.45
BRD4 O60885 1/20 0.41
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
ALOX12 P18054 1/20 0.40
KCNH2 Q12809 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
TSHR P16473 1/20 0.37
HIF1A Q16665 1/20 0.37

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
SCHEMBL10791979 0.92 TDP1 (0.57) TDP1LMNAKMT2ACYP2D6CYP2C19
SCHEMBL11292712 0.90 TDP1 (0.68) TDP1LMNAKMT2ACYP2D6CYP2C19
SCHEMBL697205 0.88 TDP1 (0.44) TDP1LMNAKMT2ACYP2D6CYP2C19
SCHEMBL10792648 0.84 TDP1 (0.51) TDP1LMNAKMT2ACYP2D6CYP2C19
SCHEMBL703762 0.79 TDP1 (0.44) TDP1LMNAKMT2ACYP2D6CYP2C19
SCHEMBL10795101 0.79 KMT2A (0.55) TDP1LMNAKMT2ACYP2D6CYP2C19
SCHEMBL10795024 0.78 CYP2D6 (0.62) TDP1LMNAKMT2ACYP2D6CYP2C19
SCHEMBL697336 0.78 BRD4 (0.49) TDP1LMNAKMT2ACYP2D6CYP2C19
SCHEMBL695900 0.78 TDP1 (0.54) TDP1LMNAKMT2ACYP2D6CYP2C19
SCHEMBL10790597 0.78 CYP2D6 (0.59) TDP1LMNAKMT2ACYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE32400-E Substituted imidazole derivatives and their use as anti-thrombosis agents FARMOS YHTYMA OY (FI) 1987-04-14 US disclosed
US-4514412-A HYPOTENSIVES, BETA BLOCKERS FARMOS YHTYMA OY (FI) 1985-04-30 US disclosed
EP-0058047-B1 SUBSTITUTED IMIDAZOLE DERIVATIVES AND THEIR PREPARATION AND USE Farmos-Yhtyma Oy (FI) 1984-11-07 EP disclosed
EP-0058047-A1 Substituted imidazole derivatives and their preparation and use Farmos-Yhtyma Oy (FI) 1982-08-18 EP disclosed