SCHEMBL8897706

SCHEMBL8897706

CCCC(O)CCCCCCCC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACACB O00763 1/20 0.52
ACACA Q13085 1/20 0.52
FFAR4 Q5NUL3 1/20 0.42
FFAR1 O14842 1/20 0.42
GPR84 Q9NQS5 7/20 0.40
NFKB1 P19838 1/20 0.37
FAAH O00519 2/20 0.35
PSMD14 O00487 2/20 0.34
PLA2G1B P04054 2/20 0.34
MMP2 P08253 2/20 0.34
ATG4B Q9Y4P1 2/20 0.34
HSP90AA1 P07900 1/20 0.34
RAD52 P43351 1/20 0.34
FDPS P14324 3/20 0.33

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
SCHEMBL8388721 0.98 ACACB (0.48) ACACBACACAFFAR4FFAR1GPR84
SCHEMBL8897109 0.91 FFAR1 (0.52) ACACBACACAFFAR4FFAR1GPR84
SCHEMBL8895607 0.91 FFAR1 (0.52) ACACBACACAFFAR4FFAR1GPR84
SCHEMBL8897199 0.91 ACACB (0.52) ACACBACACAFFAR4FFAR1GPR84
SCHEMBL30483471 0.91 ACACB (0.52) ACACBACACAFFAR4FFAR1GPR84
SCHEMBL22819360 0.91 ACACB (0.59) ACACBACACAFFAR4FFAR1GPR84
SCHEMBL6178291 0.91 ACACB (0.59) ACACBACACAFFAR4FFAR1GPR84
SCHEMBL17523920 0.89 FFAR1 (0.53) ACACBACACAFFAR4FFAR1GPR84
SCHEMBL8895497 0.89 FFAR1 (0.53) ACACBACACAFFAR4FFAR1GPR84
SCHEMBL10268276 0.89 ACACB (0.48) ACACBACACAFFAR4FFAR1GPR84

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