SCHEMBL6595284

SCHEMBL6595284

CCOC(CSc1ccc(F)cc1Br)OCC

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
PKM P14618 1/20 0.32

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
SCHEMBL31728477 1.00 MAOA (0.34) MAOAMAOBPKM
SCHEMBL6597582 0.88 MAOA (0.34) MAOAMAOB
SCHEMBL31358088 0.84 MAOA (0.36) MAOAMAOBPKM
SCHEMBL1356030 0.82 MAOA (0.34) MAOAMAOB
SCHEMBL31550334 0.81 PPARD (0.33) MAOAMAOB
SCHEMBL4798260 0.81 HTR2A (0.36)
SCHEMBL16094835 0.79 POLB (0.32)
SCHEMBL7479177 0.78 MAOA (0.57) MAOAMAOB
SCHEMBL31413592 0.76 MAOA (0.41) MAOAMAOB
SCHEMBL6595280 0.75 LMNA (0.31) PKM

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
EP-1204660-B1 SEROTONERGIC BENZOTHIOPHENES LILLY CO ELI (US) 2004-10-20 EP disclosed
EP-1204660-A1 SEROTONERGIC BENZOTHIOPHENES ELI LILLY AND COMPANY (US) 2002-05-15 EP disclosed
WO-2001009126-A1 SEROTONERGIC BENZOTHIOPHENES ELI LILLY AND COMPANY (US) 2001-02-08 WO disclosed