SCHEMBL9501765

SCHEMBL9501765

CCSc1ccc(Oc2ccc(CCl)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 9/20 0.44
MAOA P21397 2/20 0.44
ALDH1A1 P00352 2/20 0.42
APP P05067 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
TTR P02766 1/20 0.36
MAOB P27338 1/20 0.35
RAB9A P51151 2/20 0.35
ST14 Q9Y5Y6 1/20 0.34
LTA4H P09960 2/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL1391150 0.88 SLC6A4 (0.53) SLC6A4MAOAALDH1A1MAOBRAB9A
SCHEMBL9503139 0.86 MAOA (0.47) MAOAALDH1A1APPSMN1; SMN2TTR
SCHEMBL9505718 0.84 TTR (0.43) SLC6A4MAOAALDH1A1SMN1; SMN2TTR
SCHEMBL9503534 0.83 MAOA (0.50) MAOAALDH1A1MAOBRAB9ALTA4H
SCHEMBL10731219 0.82 ALDH1A1 (0.40) MAOAALDH1A1APPSMN1; SMN2TTR
SCHEMBL10731318 0.82 ALDH1A1 (0.40) SLC6A4MAOAALDH1A1APPSMN1; SMN2
SCHEMBL9503547 0.82 MAOA (0.45) MAOAALDH1A1SMN1; SMN2MAOBRAB9A
SCHEMBL9474265 0.81 ST14 (0.57) SLC6A4MAOAALDH1A1MAOBST14
SCHEMBL9502046 0.81 SLC6A4 (0.43) SLC6A4MAOARAB9A
SCHEMBL9503477 0.81 ALDH1A1 (0.39) SLC6A4MAOAALDH1A1APPTTR

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