SCHEMBL4454056

SCHEMBL4454056

CCCCc1cccc(P(=O)(Oc2ccccc2)Oc2ccccc2)c1CCCC

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
HIF1A Q16665 1/20 0.35

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
SCHEMBL4455891 0.89 L3MBTL1 (0.42) L3MBTL1TDP1
SCHEMBL4451718 0.88 L3MBTL1 (0.44) L3MBTL1TDP1HIF1A
SCHEMBL4454058 0.86 SRC (0.39) L3MBTL1HIF1A
SCHEMBL4454779 0.86 LTB4R (0.39) HIF1A
SCHEMBL4462323 0.85 PTGS2 (0.38) L3MBTL1HIF1A
SCHEMBL4452131 0.84 LTB4R (0.43) HIF1A
SCHEMBL4460811 0.82 PTGS2 (0.39) HIF1A
SCHEMBL4460866 0.81 MEN1 (0.44)
SCHEMBL4449253 0.81 LTB4R (0.43) HIF1A
SCHEMBL4454577 0.81 L3MBTL1 (0.46) L3MBTL1TDP1

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