SCHEMBL9505726

SCHEMBL9505726

CCCOc1cccc(Oc2ccc(CCl)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ACACB O00763 3/20 0.49
ACACA Q13085 3/20 0.49
LTA4H P09960 3/20 0.49
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GPBAR1 Q8TDU6 1/20 0.42
CYSLTR1 Q9Y271 1/20 0.42
GAA P10253 2/20 0.41
TTR P02766 1/20 0.41
MEN1 O00255 1/20 0.41
MITF O75030 1/20 0.41
MAPT P10636 1/20 0.41
GFER P55789 1/20 0.41
NLRP1 Q9C000 1/20 0.41
NOD2 Q9HC29 1/20 0.41
ST14 Q9Y5Y6 1/20 0.41

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
SCHEMBL9505733 0.94 LTA4H (0.57) ACACBACACALTA4HKMT2AKDM4E
SCHEMBL9503480 0.91 LTA4H (0.59) ACACBACACALTA4HKDM4EALDH1A1
SCHEMBL9504980 0.90 LTA4H (0.58) ACACBACACALTA4HGPBAR1
SCHEMBL9502738 0.87 LTA4H (0.55) ACACBACACALTA4HKMT2AKDM4E
SCHEMBL9505729 0.87 LTA4H (0.61) ACACBACACALTA4HKMT2AALDH1A1
SCHEMBL8549352 0.85 ALDH1A1 (0.54) LTA4HKMT2AKDM4EALDH1A1SMN1; SMN2
SCHEMBL9487763 0.85 KMT2A (0.58) ACACBACACALTA4HKMT2AKDM4E
SCHEMBL6054900 0.83 LTA4H (0.63) ACACBACACALTA4HKMT2AKDM4E
SCHEMBL8906190 0.82 KMT2A (0.51) KMT2AKDM4EALDH1A1SMN1; SMN2GPBAR1
SCHEMBL2417808 0.81 LMNA (0.53) LTA4HKMT2AKDM4EALDH1A1SMN1; 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