SCHEMBL4458166

SCHEMBL4458166

CCCCOP(=O)(O)c1cccc(CCC)c1CCC

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G2D Q9UNK4 2/20 0.46
ALDH1A1 P00352 1/20 0.38
HIF1A Q16665 1/20 0.38
LTB4R Q15722 1/20 0.37
LTB4R2 Q9NPC1 1/20 0.37
CYP3A4 P08684 1/20 0.36
LPAR1 Q92633 2/20 0.36
LPAR3 Q9UBY5 2/20 0.36
LPAR2 Q9HBW0 1/20 0.36

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
SCHEMBL4448583 0.92 PLA2G2D (0.46) PLA2G2DALDH1A1HIF1ACYP3A4
SCHEMBL4454045 0.92 PLA2G2D (0.40) PLA2G2DALDH1A1HIF1ALTB4RLTB4R2
SCHEMBL4452201 0.87 ALDH1A1 (0.47) PLA2G2DALDH1A1LTB4RLTB4R2
SCHEMBL4451489 0.86 PLA2G2D (0.44) PLA2G2DALDH1A1HIF1ALTB4RLTB4R2
SCHEMBL4452194 0.86 PLA2G2D (0.48) PLA2G2DALDH1A1HIF1ACYP3A4LPAR1
SCHEMBL4458164 0.86 CYP3A4 (0.38) PLA2G2DHIF1ALTB4RLTB4R2CYP3A4
SCHEMBL4462488 0.82 LTB4R (0.34) PLA2G2DALDH1A1LTB4RLTB4R2
SCHEMBL4460867 0.82 ALDH1A1 (0.45) PLA2G2DALDH1A1
SCHEMBL4449254 0.79 LTB4R (0.44) ALDH1A1HIF1ALTB4RLTB4R2
SCHEMBL1537965 0.79 GABRA1 (0.36) ALDH1A1LTB4RLTB4R2

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