SCHEMBL8898976

SCHEMBL8898976

CCCCCCC(C)(C)CCC(O)CCC

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.40
FFAR4 Q5NUL3 1/20 0.40
ACACB O00763 1/20 0.40
ACACA Q13085 1/20 0.40
GPR84 Q9NQS5 8/20 0.38
FDPS P14324 3/20 0.35
SPHK1 Q9NYA1 1/20 0.35
GGPS1 O95749 1/20 0.35
NFKB1 P19838 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL8898388 0.86 ACACB (0.46) FFAR1FFAR4ACACBACACAGPR84
SCHEMBL8897250 0.86 FFAR4 (0.46) FFAR1FFAR4ACACBACACAGPR84
SCHEMBL8898817 0.83 ACACB (0.32) ACACBACACAFDPS
SCHEMBL8898934 0.82 GGPS1 (0.41) FFAR1GPR84FDPSSPHK1GGPS1
SCHEMBL8896548 0.82 GPR84 (0.42) FFAR1FFAR4ACACBACACAGPR84
SCHEMBL8896578 0.80 FFAR1 (0.48) FFAR1FFAR4ACACBACACAGPR84
SCHEMBL8897904 0.80 ACACB (0.48) FFAR1FFAR4ACACBACACAGPR84
SCHEMBL8898395 0.79 FFAR4 (0.41) FFAR1FFAR4ACACBACACAGPR84
SCHEMBL8897680 0.79 ACACB (0.32) ACACBACACAFDPS
SCHEMBL10258113 0.78 FFAR4 (0.47) FFAR1FFAR4ACACBACACAGPR84

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