SCHEMBL27930278

SCHEMBL27930278

COCCCOc1cc(CCC(C)CC(=O)O)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.45
REN P00797 7/20 0.44
LDHA P00338 1/20 0.43
SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL5076405 0.84 STAT3 (0.48) STAT3RENSIGMAR1
SCHEMBL21358212 0.81 REN (0.58) REN
SCHEMBL14538389 0.80 PPARA (0.57) REN
SCHEMBL3757267 0.80 STAT3 (0.52) STAT3RENSIGMAR1
SCHEMBL6947316 0.80 STAT3 (0.52) STAT3REN
SCHEMBL6941201 0.80 PPARA (0.45) RENLDHASIGMAR1
SCHEMBL6941202 0.80 PPARA (0.45) RENLDHASIGMAR1
SCHEMBL16973663 0.80 SIGMAR1 (0.50) STAT3RENSIGMAR1
SCHEMBL17709273 0.79 GAA (0.59) RENLDHA
SCHEMBL6943609 0.79 PPARA (0.56) REN

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101120010-B Metallocene-based phosphorus chiral phosphines SOLVIAS AG 2013-07-03 CN disclosed