SCHEMBL28290021

SCHEMBL28290021

CCCCCC(CC)OC(C)=S

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.38
PRKCD Q05655 1/20 0.38
LMNA P02545 1/20 0.35
FAAH O00519 1/20 0.35
CTSK P43235 1/20 0.34
FDPS P14324 4/20 0.33
SMPD1 P17405 3/20 0.33
OPRM1 P35372 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
GPR84 Q9NQS5 2/20 0.32
ZDHHC7 Q9NXF8 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
SPHK1 Q9NYA1 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
SCHEMBL5902763 0.89 LMNA (0.41) LMNAFAAHFDPSSMPD1CA12
SCHEMBL28266188 0.85 PRKCA (0.40) PRKCAPRKCDCTSK
SCHEMBL11696302 0.83 PRKCA (0.38) PRKCAPRKCDLMNACTSKFDPS
SCHEMBL15173069 0.82 PRKCA (0.37) PRKCAPRKCDLMNACTSKSMPD1
SCHEMBL8372788 0.81 CTSK (0.42) PRKCAPRKCDCTSKFDPSCA12
SCHEMBL15173417 0.80 SPHK1 (0.38) PRKCAPRKCDLMNASMPD1OPRM1
Potassium Ion SCHEMBL28367434 0.80 CA12 (0.47) PRKCAPRKCDLMNAFAAHCTSK
SCHEMBL15173170 0.80 SPHK1 (0.38) PRKCAPRKCDLMNASMPD1OPRM1
SCHEMBL30833261 0.80 LMNA (0.38) PRKCAPRKCDLMNAFAAHFDPS
SCHEMBL112743 0.79 PRKCA (0.47) PRKCAPRKCDFAAHCTSKCA1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106459615-B Non-aqueous sound damping composition comprising a non-pulverulent polyacrylate binder and a radically polymerizable compound 巴斯夫欧洲公司 2019-05-07 CN disclosed