SCHEMBL4609011

SCHEMBL4609011

CCCCCCCCC([S])CCCCCC

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
THRB P10828 1/20 0.50
LMNA P02545 1/20 0.48
DNM1 Q05193 2/20 0.48
OPRM1 P35372 1/20 0.46
GPR84 Q9NQS5 3/20 0.42
FDPS P14324 3/20 0.42
SPHK1 Q9NYA1 1/20 0.42
FFAR1 O14842 1/20 0.42
EPHX1 P07099 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL3421738 1.00 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL7700484 1.00 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL7696737 1.00 TSHR (0.50) TSHRTHRBLMNADNM1OPRM1
SCHEMBL10423266 0.97 DNM1 (0.52) TSHRTHRBLMNADNM1OPRM1
SCHEMBL10862622 0.97 DNM1 (0.52) TSHRTHRBLMNADNM1OPRM1
SCHEMBL3089816 0.97 OPRM1 (0.48) TSHRTHRBLMNADNM1OPRM1
SCHEMBL8957564 0.94 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1
SCHEMBL8191453 0.94 DNM1 (0.48) TSHRTHRBLMNADNM1OPRM1
SCHEMBL5514104 0.91 OPRM1 (0.43) TSHRTHRBLMNADNM1OPRM1
SCHEMBL9732230 0.88 TSHR (0.44) TSHRTHRBLMNADNM1OPRM1

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-1976505-A1 COMBRETASTATIN DERIVATIVES AND RELATED THERAPEUTIC METHODS Abraxis BioScience, Inc. (US) 2008-10-08 EP disclosed
WO-2007059118-A1 COMBRETASTATIN DERIVATIVES AND RELATED THERAPEUTIC METHODS ABRAXIS BIOSCIENCE, INC. (US) 2007-05-24 WO disclosed
US-5650430-A Radicicol derivatives, their preparation and their anti-tumor activity SANKYO COMPANY, LIMITED (JP) 1997-07-22 US disclosed
US-5597846-A ESTERS OF RADICICOL SANKYO COMPANY, LIMITED (JP) 1997-01-28 US disclosed
WO-1991018905-A1 RADICICOL DERIVATIVES, THEIR PREPARATION AND THEIR ANTI-TUMOR ACTIVITY SANKYO COMPANY LIMITED (JP) 1991-12-12 WO disclosed
EP-0460950-A1 Radicicol derivatives, their preparation and their anti-tumour activity Sankyo Company Limited (JP) 1991-12-11 EP disclosed