SCHEMBL9501883

SCHEMBL9501883

CCCSc1cccc(Oc2ccc(CCl)cc2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.41
LTA4H P09960 3/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
ALDH1A1 P00352 5/20 0.36
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
LMNA P02545 1/20 0.35
ADORA3 P0DMS8 1/20 0.34
OPRK1 P41145 1/20 0.34
MEN1 O00255 1/20 0.34
MITF O75030 1/20 0.34
GAA P10253 1/20 0.34
GFER P55789 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL9503489 0.92 LTA4H (0.43) TTRLTA4HMAOAMAOBMTNR1A
SCHEMBL9505718 0.88 TTR (0.43) TTRLTA4HMAOAALDH1A1HTT
SCHEMBL9503139 0.85 MAOA (0.47) TTRLTA4HMAOAMAOBMTNR1A
SCHEMBL9505086 0.82 TTR (0.42) TTRLTA4HALDH1A1HTTSMN1; SMN2
SCHEMBL9505014 0.79 TTR (0.38) TTRLTA4HALDH1A1HTTSMN1; SMN2
SCHEMBL11327892 0.79 LTA4H (0.41) LTA4HALDH1A1MAPTLMNAMEN1
SCHEMBL9505733 0.78 LTA4H (0.57) LTA4HALDH1A1SMN1; SMN2KDM4EKMT2A
SCHEMBL9505726 0.78 ACACB (0.49) TTRLTA4HALDH1A1SMN1; SMN2KDM4E
SCHEMBL8549352 0.78 ALDH1A1 (0.54) TTRLTA4HMAOBALDH1A1HTT
SCHEMBL9503534 0.76 MAOA (0.50) LTA4HMAOAMAOBALDH1A1KDM4E

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