SCHEMBL10817065

SCHEMBL10817065

Cc1ccccc1Oc1ccc(CBr)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 6/20 0.49
LPAR5 Q9H1C0 6/20 0.49
ALDH1A1 P00352 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
HPGD P15428 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAPK14 Q16539 1/20 0.45
TSHR P16473 2/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
AR P10275 2/20 0.43
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL7690257 0.84 ALDH1A1 (0.59) LPAR1LPAR5ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL17521526 0.83 LPAR1 (0.51) LPAR1LPAR5ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL1746823 0.81 LTA4H (0.60) LPAR1LPAR5ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL507354 0.81 ST14 (0.52) LPAR1LPAR5ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL1582083 0.81 LPAR1 (0.49) LPAR1LPAR5ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL9502693 0.81 TTR (0.50) LPAR1LPAR5ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL11604236 0.79 SLC6A4 (0.54) LPAR1LPAR5ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL172615 0.78 HTR2A (0.55) LPAR1LPAR5ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL28816731 0.78 LTA4H (0.55) LPAR1LPAR5ALDH1A1SMN1; SMN2CYP1A2
SCHEMBL3520758 0.78 PARP10 (0.51) LPAR1LPAR5NR3C1

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
EP-0132606-B1 BENZIMIDAZOLE DERIVATIVES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-07 EP disclosed
EP-0132606-A1 Benzimidazole derivatives, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-02-13 EP disclosed