SCHEMBL9505033

SCHEMBL9505033

C=CCc1ccsc1Oc1ccc(CCl)cc1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
ALOX12 P18054 1/20 0.37
XDH P47989 1/20 0.30

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
SCHEMBL8854006 0.81 GABRA1 (0.34) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL9505724 0.80 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1
SCHEMBL9501893 0.78 ALDH1A1 (0.36) ALDH1A1
SCHEMBL9501888 0.76 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL9503496 0.75 PDE4A (0.35) ALDH1A1TP53
SCHEMBL9505096 0.73 GSK3B (0.35)
SCHEMBL9502742 0.71 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL10737040 0.70 KCNH2 (0.31)
SCHEMBL1653597 0.67 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL15056035 0.67 GABRA1 (0.33)

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