SCHEMBL8896578

SCHEMBL8896578

CCCCCCCC(O)CCC(C)(C)CC

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 1/20 0.48
GPR84 Q9NQS5 8/20 0.46
ACACB O00763 1/20 0.44
ACACA Q13085 1/20 0.44
NFKB1 P19838 1/20 0.43
FAAH O00519 1/20 0.40
PSMD14 O00487 2/20 0.40
PLA2G1B P04054 2/20 0.40
MMP2 P08253 2/20 0.40
ATG4B Q9Y4P1 2/20 0.40
HSP90AA1 P07900 1/20 0.40
RAD52 P43351 1/20 0.40
FDPS P14324 3/20 0.39
SPHK1 Q9NYA1 1/20 0.39

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
SCHEMBL8895374 0.94 FFAR1 (0.50) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8898396 0.90 FFAR4 (0.46) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8896228 0.88 ACACB (0.48) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8897250 0.86 FFAR4 (0.46) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8897904 0.84 ACACB (0.48) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8897886 0.83 FFAR1 (0.52) FFAR1FFAR4GPR84ACACBACACA
SCHEMBL8897680 0.83 ACACB (0.32) ACACBACACAFDPS
SCHEMBL8343527 0.82 FFAR1 (0.64) FFAR1FFAR4GPR84NFKB1FAAH
SCHEMBL22395513 0.82 FFAR1 (0.64) FFAR1FFAR4GPR84NFKB1FAAH
SCHEMBL22395591 0.82 FFAR1 (0.64) FFAR1FFAR4GPR84NFKB1FAAH

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