SCHEMBL9767347

SCHEMBL9767347

O=C1C=C(OCCCBr)CN1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.53

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
SCHEMBL7770871 0.76
SCHEMBL9767083 0.74 HTT (0.50) HTT
SCHEMBL9767015 0.72 HTT (0.51) HTT
SCHEMBL145648 0.69
SCHEMBL9766990 0.64 HTT (0.43) HTT
SCHEMBL1067346 0.58 HTT (0.45) HTT
SCHEMBL9685442 0.58 HTT (0.38) HTT
SCHEMBL17911632 0.57 KCNA3 (0.38)
SCHEMBL2530176 0.57 KCNA3 (0.50)
SCHEMBL6470821 0.56

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5072006-A Chemical intermeidate; hypotensive agents, muscle relaxants RECHERCHE SYNTEX FRANCE S.A. (FR) 1991-12-10 US disclosed
US-4997846-A Smooth muscle relaxants, hypotensives RESEARCHE SYNTEX FRANCE, S.A. (FR) 1991-03-05 US disclosed
EP-0377966-A2 Novel benzopyranylpyrrolinone derivatives RECHERCHE SYNTEX FRANCE SA (FR) 1990-07-18 EP disclosed