SCHEMBL4454045

SCHEMBL4454045

CCCOP(=O)(O)c1cccc(CCC)c1CCC

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G2D Q9UNK4 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
DAO P14920 1/20 0.32
HIF1A Q16665 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
SCHEMBL4458166 0.92 PLA2G2D (0.46) PLA2G2DALDH1A1LTB4RLTB4R2HIF1A
SCHEMBL4452201 0.90 ALDH1A1 (0.47) PLA2G2DALDH1A1MEN1KMT2ALTB4R
SCHEMBL4451489 0.89 PLA2G2D (0.44) PLA2G2DALDH1A1MEN1KMT2ALTB4R
SCHEMBL4451699 0.85 PLA2G2D (0.41) PLA2G2DALDH1A1MEN1KMT2AHIF1A
SCHEMBL4462488 0.85 LTB4R (0.34) PLA2G2DALDH1A1MEN1KMT2ALTB4R
SCHEMBL4454043 0.85 MEN1 (0.40) ALDH1A1MEN1KMT2ALTB4RLTB4R2
SCHEMBL4448583 0.83 PLA2G2D (0.46) PLA2G2DALDH1A1HIF1A
SCHEMBL1537965 0.81 GABRA1 (0.36) ALDH1A1MEN1KMT2ALTB4RLTB4R2
SCHEMBL4460503 0.80 LTB4R (0.42) ALDH1A1LTB4RLTB4R2HIF1A
SCHEMBL4455892 0.80 SRC (0.41) 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