SCHEMBL9505729

SCHEMBL9505729

CCCOc1ccc(Oc2ccc(CCl)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 6/20 0.61
LMNA P02545 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
ALDH1A1 P00352 1/20 0.46
HTT P42858 2/20 0.46
HSD17B10 Q99714 1/20 0.46
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
TSHR P16473 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ACACB O00763 1/20 0.42
ACACA Q13085 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
SCHEMBL2417808 0.94 LMNA (0.53) LTA4HLMNAL3MBTL1ALDH1A1HTT
SCHEMBL9503567 0.92 LTA4H (0.63) LTA4HALDH1A1TSHRSMN1; SMN2MEN1
SCHEMBL9503541 0.89 LTA4H (0.66) LTA4HTSHRMEN1KMT2A
SCHEMBL9505726 0.87 ACACB (0.49) LTA4HALDH1A1SMN1; SMN2MAPTMEN1
SCHEMBL2995440 0.86 TSHR (0.56) LTA4HALDH1A1TSHRSMN1; SMN2
SCHEMBL9723672 0.85 LTA4H (0.79) LTA4HLMNAL3MBTL1CA12CA1
SCHEMBL6158908 0.84 LTA4H (0.61) LTA4HLMNAALDH1A1CA12CA1
SCHEMBL9502090 0.84 LMNA (0.45) LTA4HLMNAL3MBTL1ALDH1A1HTT
SCHEMBL6018241 0.82 NR5A1 (0.58) LTA4HTSHRMEN1KMT2A
SCHEMBL9705907 0.81 HRH3 (0.42) LTA4HTSHR

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