SCHEMBL10791979

SCHEMBL10791979

Cc1ccc(Cn2ccnc2C(O)c2cccc(C)c2C)cc1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.57
LMNA P02545 1/20 0.49
KMT2A Q03164 3/20 0.48
CYP1A2 P05177 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.46
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL10790632 0.92 TDP1 (0.56) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL11292712 0.91 TDP1 (0.68) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL703762 0.88 TDP1 (0.44) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL10792648 0.82 TDP1 (0.51) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL10792535 0.79 KMT2A (0.57) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL697205 0.79 TDP1 (0.44) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL696289 0.79 TDP1 (0.54) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL695900 0.79 TDP1 (0.54) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL698831 0.78 TDP1 (0.43) TDP1LMNAKMT2ACYP1A2CYP2D6
SCHEMBL697990 0.78 TDP1 (0.46) TDP1LMNACYP1A2CYP2D6CYP2C19

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