SCHEMBL9767083

SCHEMBL9767083

C=CCCOC1=CC(=O)NC1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.50
KDM4E B2RXH2 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
SCHEMBL9767015 0.84 HTT (0.51) HTT
SCHEMBL9767347 0.74 HTT (0.53) HTT
SCHEMBL9766990 0.62 HTT (0.43) HTT
SCHEMBL16581536 0.61 ALDH1A1 (0.41) KDM4E
SCHEMBL28820693 0.60 KDM4E (0.40) KDM4E
SCHEMBL16581566 0.58 KDM4E (0.62) HTTKDM4E
SCHEMBL31267673 0.57 LPAR3 (0.36)
SCHEMBL29054688 0.57 MAPT (0.42) KDM4E
Allylanisole SCHEMBL4737421 0.56 KCNA3 (0.58) KDM4E
SCHEMBL2267266 0.56 ALDH1A1 (0.50) KDM4E

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