SCHEMBL9502738

SCHEMBL9502738

CCOc1cccc(Oc2ccc(CCl)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.55
TP53 P04637 1/20 0.47
CYP3A4 P08684 1/20 0.47
ACACB O00763 1/20 0.47
ACACA Q13085 1/20 0.47
MAPK1 P28482 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MEN1 O00255 1/20 0.43
MITF O75030 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
GFER P55789 1/20 0.43
KMT2A Q03164 1/20 0.43
NLRP1 Q9C000 1/20 0.43
NOD2 Q9HC29 1/20 0.43
TTR P02766 1/20 0.43
ST14 Q9Y5Y6 1/20 0.43
LMNA P02545 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL8549352 0.88 ALDH1A1 (0.54) LTA4HMAPK1SMN1; SMN2ALDH1A1MEN1
SCHEMBL9505733 0.87 LTA4H (0.57) LTA4HACACBACACASMN1; SMN2ALDH1A1
SCHEMBL9505726 0.87 ACACB (0.49) LTA4HACACBACACASMN1; SMN2ALDH1A1
SCHEMBL6158908 0.86 LTA4H (0.61) LTA4HSMN1; SMN2ALDH1A1MEN1MAPT
SCHEMBL11745385 0.86 LTA4H (0.73) LTA4HTP53CYP3A4ACACBACACA
SCHEMBL921128 0.85 ST14 (0.63) LTA4HTP53CYP3A4ACACBACACA
SCHEMBL9503480 0.84 LTA4H (0.59) LTA4HACACBACACASMN1; SMN2ALDH1A1
SCHEMBL9488001 0.84 TP53 (0.63) LTA4HTP53CYP3A4ACACBACACA
SCHEMBL9504980 0.83 LTA4H (0.58) LTA4HACACBACACA
SCHEMBL9502727 0.83 SMN1; SMN2 (0.61) LTA4HSMN1; SMN2ALDH1A1TTRKDM4E

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 5 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