SCHEMBL9502164

SCHEMBL9502164

CCCc1cccc(Oc2ccc(CCl)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 2/20 0.50
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 2/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
RAB9A P51151 1/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
TTR P02766 1/20 0.42
FFAR1 O14842 3/20 0.42
FFAR4 Q5NUL3 2/20 0.42
CETP P11597 1/20 0.42
TAAR1 Q96RJ0 1/20 0.40
ALOX5 P09917 1/20 0.39

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
SCHEMBL25381878 0.90 FDFT1 (0.57) FDFT1ALDH1A1KDM4EHTTSMN1; SMN2
SCHEMBL9502073 0.87 ALDH1A1 (0.48) ALDH1A1KDM4EHTTSMN1; SMN2TSHR
SCHEMBL26218121 0.86 TAAR1 (0.50) FDFT1ALDH1A1KDM4EHTTSMN1; SMN2
SCHEMBL13406682 0.85 ALDH1A1 (0.59) FDFT1ALDH1A1KDM4EHTTSMN1; SMN2
SCHEMBL1696397 0.84 KDM4E (0.55) FDFT1ALDH1A1KDM4EHTTSMN1; SMN2
SCHEMBL9501778 0.84 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2RAB9ATTRFFAR1
SCHEMBL14127822 0.83 FFAR1 (0.52) FDFT1ALDH1A1KDM4EHTTSMN1; SMN2
SCHEMBL21770981 0.83 KDM4E (0.54) FDFT1ALDH1A1KDM4EHTTSMN1; SMN2
Ammonia Solution, Strong SCHEMBL27879510 0.83 KDM4E (0.54) FDFT1ALDH1A1KDM4EHTTSMN1; SMN2
SCHEMBL13857071 0.83 ALDH1A1 (0.46) FDFT1ALDH1A1KDM4EHTTSMN1; 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