SCHEMBL4448581

SCHEMBL4448581

CCCCOP(=O)(OCCCC)c1cccc(CCCC)c1CCCC

nearest known ligand 0.47

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.38
HIF1A Q16665 1/20 0.36
GAA P10253 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
SCHEMBL4451487 0.94 MEN1 (0.38) HIF1A
SCHEMBL4458164 0.91 CYP3A4 (0.38) CYP3A4HIF1A
SCHEMBL4460866 0.90 MEN1 (0.44)
SCHEMBL4451490 0.86 HIF1A (0.42) CYP3A4HIF1AGAA
SCHEMBL4448583 0.86 PLA2G2D (0.46) CYP3A4HIF1AGAA
SCHEMBL4452190 0.85 CYP3A4 (0.40) CYP3A4HIF1A
SCHEMBL4460811 0.85 PTGS2 (0.39) HIF1A
SCHEMBL4454043 0.82 MEN1 (0.40) GAA
SCHEMBL4455971 0.80 CYP3A4 (0.41) CYP3A4HIF1A
SCHEMBL4448616 0.80 MEN1 (0.45) HIF1AGAA

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