SCHEMBL6624316

SCHEMBL6624316

O=C1c2ccsc2CCC1CCCCBr

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 14/20 0.49
CYP19A1 P11511 1/20 0.32
NOS2 P35228 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
SCHEMBL6622016 0.99 HTR2C (0.48) HTR2CCYP19A1NOS2
SCHEMBL3842816 0.80 HTR2C (0.51) HTR2CCYP19A1NOS2
SCHEMBL6100478 0.76 HTR2C (0.47) HTR2CNOS2
SCHEMBL6196420 0.74 HTR2C (0.45) HTR2CNOS2
SCHEMBL15606087 0.73 CYP19A1 (0.50) HTR2CCYP19A1
SCHEMBL6198185 0.73 HTR2C (0.43) HTR2CNOS2
SCHEMBL9385024 0.73 HTR2C (0.47) HTR2C
SCHEMBL914478 0.71 NOS2 (0.43) HTR2CNOS2
SCHEMBL13211525 0.70 CYP19A1 (0.42) HTR2CCYP19A1
SCHEMBL1339830 0.68 HTR2C (0.38) HTR2C

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-1181294-B1 NOVEL DERIVATIVES AND ANALOGUES OF GALANTHAMIN SANOCHEMIA PHARMAZEUTIKA AG (AT) 2004-03-31 EP disclosed
EP-1181294-A1 NOVEL DERIVATIVES AND ANALOGUES OF GALANTHAMIN Sanochemia Pharmazeutika Aktiengesellschaft (AT) 2002-02-27 EP disclosed
WO-2001074820-A1 NOVEL DERIVATIVES AND ANALOGUES OF GALANTHAMIN SANOCHEMIA PHARMAZEUTIKA AKTIENGESELLSCHAFT (AT) 2001-10-11 WO disclosed