SCHEMBL9501778

SCHEMBL9501778

CCCc1ccc(Oc2ccc(CCl)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.51
RAB9A P51151 2/20 0.51
THRB P10828 1/20 0.44
ACACB O00763 1/20 0.44
ACACA Q13085 1/20 0.44
LPL P06858 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
FFAR1 O14842 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 1/20 0.39
CASP3 P42574 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
TTR P02766 1/20 0.39
LTA4H P09960 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
SCHEMBL2202805 0.89 THRB (0.52) ALDH1A1RAB9ATHRBACACBACACA
SCHEMBL9502103 0.88 LTA4H (0.44) ALDH1A1RAB9ATHRBSMN1; SMN2LTA4H
SCHEMBL1445953 0.87 LPL (0.50) ALDH1A1RAB9ATHRBLPLLIPG
SCHEMBL9502761 0.86 THRB (0.49) ALDH1A1THRBLPLLIPGKMT2A
SCHEMBL9501783 0.85 ESR1 (0.52) ALDH1A1THRBLPLLIPGKMT2A
SCHEMBL9502164 0.84 FDFT1 (0.50) ALDH1A1RAB9AFFAR1SMN1; SMN2TTR
SCHEMBL8551187 0.84 ST14 (0.48) ALDH1A1FFAR1KMT2ATTRLTA4H
SCHEMBL1338731 0.84 ST14 (0.48) ALDH1A1FFAR1KMT2ATTRLTA4H
SCHEMBL8512126 0.83 PPARA (0.54) ALDH1A1RAB9ATHRBACACBACACA
SCHEMBL9505702 0.83 SMN1; SMN2 (0.49) ALDH1A1RAB9ANPC1MAPTSMN1; SMN2

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