SCHEMBL4610125

SCHEMBL4610125

CCCCC(C)CC(C)CC[S]

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.35
OPRM1 P35372 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
ALDH1A1 P00352 3/20 0.31
TDP1 Q9NUW8 1/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 2/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
CYP3A4 P08684 1/20 0.30
FDPS P14324 1/20 0.30

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
SCHEMBL1110033 0.93 OPRM1 (0.42) DNM1OPRM1ACE2LMNATSHR
SCHEMBL3549862 0.90
SCHEMBL2504628 0.87 DNM1 (0.43) DNM1OPRM1ACE2ALDH1A1TDP1
SCHEMBL5510325 0.82 ACE2 (0.48) DNM1OPRM1ACE2LMNATSHR
SCHEMBL4277175 0.81 OPRM1 (0.50) DNM1OPRM1ACE2LMNATSHR
SCHEMBL4279140 0.81 TSHR (0.46) DNM1OPRM1ACE2ALDH1A1TDP1
SCHEMBL5506076 0.80 ACE2 (0.52) DNM1OPRM1ACE2LMNATSHR
SCHEMBL31509131 0.79 DNM1 (0.50) DNM1OPRM1ACE2LMNATSHR
SCHEMBL4273912 0.79 DNM1 (0.50) DNM1OPRM1ACE2LMNATSHR
SCHEMBL31508708 0.79 DNM1 (0.50) DNM1OPRM1ACE2LMNATSHR

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