SCHEMBL4451710

SCHEMBL4451710

CCCCc1cccc(POC2CCC2)c1CCCC

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.32
PTGS2 P35354 1/20 0.32
BCHE P06276 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
SCHEMBL4454173 0.94 PTGS2 (0.33) ALOX5PTGS2BCHE
SCHEMBL4454847 0.89
SCHEMBL4451816 0.83 HTR2A (0.30)
SCHEMBL4452174 0.78 PTGS2 (0.41) ALOX5PTGS2
SCHEMBL4452258 0.77 PTGS2 (0.36) ALOX5PTGS2
SCHEMBL4452177 0.76 PTGS2 (0.36) ALOX5PTGS2
SCHEMBL4455062 0.76 ALOX5 (0.36) ALOX5PTGS2
SCHEMBL27931973 0.75 BCHE (0.38) ALOX5PTGS2BCHE
SCHEMBL4446484 0.73 LTA4H (0.36) ALOX5PTGS2
SCHEMBL15658256 0.73 LIPG (0.39) ALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612148-B2 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2009-11-03 US disclosed
US-20080146733-A1 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2008-06-19 US disclosed