SCHEMBL28704367

SCHEMBL28704367

CC(C)CCCCC(O)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.64
FFAR1 O14842 1/20 0.64
BLM P54132 1/20 0.50
KDM4C Q9H3R0 4/20 0.48
TET2 Q6N021 3/20 0.48
KDM4A O75164 3/20 0.48
KDM2A Q9Y2K7 3/20 0.48
TET3 O43151 1/20 0.48
OR51E2 Q9H255 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.41
TBXAS1 P24557 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
PHF8 Q9UPP1 1/20 0.40

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
SCHEMBL22634111 0.98 GPR84 (0.68) GPR84FFAR1BLMKDM4CTET2
SCHEMBL27968536 0.98 GPR84 (0.68) GPR84FFAR1BLMKDM4CTET2
SCHEMBL27780074 0.98 GPR84 (0.68) GPR84FFAR1BLMKDM4CTET2
SCHEMBL6555168 0.98 GPR84 (0.68) GPR84FFAR1BLMKDM4CTET2
SCHEMBL28615741 0.98 GPR84 (0.68) GPR84FFAR1BLMKDM4CTET2
SCHEMBL9446362 0.98 GPR84 (0.68) GPR84FFAR1BLMKDM4CTET2
SCHEMBL4626344 0.98 GPR84 (0.68) GPR84FFAR1BLMKDM4CTET2
SCHEMBL6037095 0.98 GPR84 (0.68) GPR84FFAR1BLMKDM4CTET2
SCHEMBL14661633 0.95 GPR84 (0.58) GPR84FFAR1BLMKDM4CTET2
SCHEMBL16428981 0.95 GPR84 (0.58) GPR84FFAR1BLMKDM4CTET2

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-114044886-A Production method of polycaprolactone 青岛科技大学 2022-02-15 CN disclosed