SCHEMBL9505702

SCHEMBL9505702

CCc1ccc(Oc2ccc(CCl)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.49
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
CYP2C19 P33261 1/20 0.41
TTR P02766 1/20 0.41
ST14 Q9Y5Y6 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
LTA4H P09960 3/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
ATM Q13315 1/20 0.39
TP53 P04637 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 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
SCHEMBL8551187 0.88 ST14 (0.48) TTRST14TDP1ALDH1A1LTA4H
SCHEMBL475215 0.88 SMN1; SMN2 (0.48) SMN1; SMN2NPC1RAB9ACYP2C19ST14
SCHEMBL8925998 0.88 SMN1; SMN2 (0.48) SMN1; SMN2NPC1RAB9ACYP2C19ST14
SCHEMBL1338731 0.88 ST14 (0.48) TTRST14TDP1ALDH1A1LTA4H
SCHEMBL52437 0.85 TP53 (0.50) SMN1; SMN2NPC1RAB9ATDP1L3MBTL1
SCHEMBL9502073 0.83 ALDH1A1 (0.48) SMN1; SMN2TTRST14TDP1ALDH1A1
SCHEMBL7801043 0.83 TP53 (0.48) SMN1; SMN2NPC1RAB9ATDP1L3MBTL1
SCHEMBL6158908 0.83 LTA4H (0.61) SMN1; SMN2NPC1RAB9ATDP1ALDH1A1
SCHEMBL9501778 0.83 ALDH1A1 (0.51) SMN1; SMN2NPC1RAB9ATTRALDH1A1
SCHEMBL6161837 0.82 TEAD4 (0.52) SMN1; SMN2TTRST14TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0186190-B1 BENZIMIDAZOLE DERIVATIVES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-05-26 EP disclosed
EP-0132606-B1 BENZIMIDAZOLE DERIVATIVES, AND THEIR PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-10-07 EP disclosed
US-4663339-A Acaricidal and insecticidal substituted 1-phenylalkylbenzimidazoles SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-05-05 US disclosed
US-4612323-A Insecticidal and acaricidal derivatives of 1-benzylbenzimidazole SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-09-16 US disclosed
EP-0186190-A2 Benzimidazole derivatives, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-07-02 EP disclosed
EP-0132606-A1 Benzimidazole derivatives, and their production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1985-02-13 EP disclosed