SCHEMBL5040191

SCHEMBL5040191

C=CCCCC(CCC=CCCCCC(C)c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.36
TAAR1 Q96RJ0 3/20 0.33
TRPA1 O75762 3/20 0.32
AOC3 Q16853 2/20 0.31

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
SCHEMBL2750250 0.85 RIPK1 (0.47) RIPK1TAAR1TRPA1AOC3
SCHEMBL17183737 0.84 RIPK1 (0.46) RIPK1TAAR1TRPA1AOC3
SCHEMBL17183735 0.84 RIPK1 (0.46) RIPK1TAAR1TRPA1AOC3
SCHEMBL17183771 0.84 RIPK1 (0.46) RIPK1TAAR1TRPA1AOC3
SCHEMBL17183818 0.84 RIPK1 (0.46) RIPK1TAAR1TRPA1AOC3
SCHEMBL17183640 0.84 RIPK1 (0.46) RIPK1TAAR1TRPA1AOC3
SCHEMBL17183799 0.84 RIPK1 (0.46) RIPK1TAAR1TRPA1AOC3
SCHEMBL4635937 0.84 RIPK1 (0.48) RIPK1TAAR1TRPA1AOC3
SCHEMBL2247658 0.82 USP2 (0.39)
SCHEMBL6142589 0.80 CYP2C19 (0.34) TAAR1

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
EP-1919972-A1 PROCESS FOR MANUFACTURING A THERMOPLASTIC ELASTOMERIC MATERIAL Pirelli & C. S.p.A. (IT) 2008-05-14 EP claimed
WO-2007025556-A1 PROCESS FOR MANUFACTURING A THERMOPLASTIC ELASTOMERIC MATERIAL PIRELLI & C. S.P.A. (IT) 2007-03-08 WO claimed