SCHEMBL8895795

SCHEMBL8895795

CCCCC(O)CCCCCCCC(C)C

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.52
FFAR4 Q5NUL3 1/20 0.52
GPR84 Q9NQS5 8/20 0.48
SPHK1 Q9NYA1 1/20 0.46
NFKB1 P19838 1/20 0.45
FAAH O00519 2/20 0.44
ACE2 Q9BYF1 1/20 0.42
LMNA P02545 1/20 0.42
FDPS P14324 3/20 0.41

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
SCHEMBL17526524 1.00 FFAR1 (0.52) FFAR1FFAR4GPR84SPHK1NFKB1
SCHEMBL17526436 1.00 FFAR1 (0.52) FFAR1FFAR4GPR84SPHK1NFKB1
SCHEMBL31038971 0.97 FFAR4 (0.48) FFAR1FFAR4GPR84SPHK1NFKB1
SCHEMBL17526456 0.97 FFAR4 (0.48) FFAR1FFAR4GPR84SPHK1NFKB1
SCHEMBL17526455 0.97 FFAR4 (0.48) FFAR1FFAR4GPR84SPHK1NFKB1
SCHEMBL8898834 0.95 FFAR1 (0.57) FFAR1FFAR4GPR84SPHK1NFKB1
SCHEMBL8898006 0.95 FFAR1 (0.57) FFAR1FFAR4GPR84SPHK1NFKB1
SCHEMBL6062106 0.95 FFAR1 (0.57) FFAR1FFAR4GPR84SPHK1NFKB1
SCHEMBL6759532 0.95 FFAR1 (0.57) FFAR1FFAR4GPR84SPHK1NFKB1
SCHEMBL16114411 0.95 FFAR1 (0.57) FFAR1FFAR4GPR84SPHK1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0531715-B1 Process for producing alcohols and ketones SUMITOMO CHEMICAL CO (JP) 1997-11-05 EP disclosed
US-5426237-A Oxidation of straight, branched or cyclic alkanes and benzene derivatives in presence of transition metal catalyst and aldehyde SUMITOMO CHEMICAL CO., LTD. (JP) 1995-06-20 US disclosed
EP-0531715-A1 Process for producing alcohols and ketones SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-03-17 EP disclosed