SCHEMBL28334565

SCHEMBL28334565

CCCCCCCCC(CCCCCCC)OC(=O)C1(C(=O)O)CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.38
FFAR1 O14842 2/20 0.38
MAPT P10636 2/20 0.37
LCK P06239 1/20 0.37
PPARD Q03181 1/20 0.37
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
FAAH O00519 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
ACE2 Q9BYF1 1/20 0.35
ZDHHC7 Q9NXF8 1/20 0.34
MAPK1 P28482 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
SCHEMBL5368458 1.00 GPR84 (0.38) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5370063 0.99 GPR84 (0.37) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5379168 0.97 GPR84 (0.36) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5374405 0.97 GPR84 (0.36) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5370779 0.97 GPR84 (0.36) GPR84FFAR1MAPTLCKPPARD
SCHEMBL25245958 0.95 FAAH (0.35) GPR84FFAR1MAPTLCKPPARD
SCHEMBL2917640 0.94 GPR84 (0.36) GPR84FFAR1MAPTLCKPPARD
SCHEMBL27557032 0.92 FAAH (0.38) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5369074 0.92 FAAH (0.33) GPR84FFAR1MAPTLCKPPARD
SCHEMBL5371272 0.92 FAAH (0.33) GPR84FFAR1MAPTLCKPPARD

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-105885086-B Preparation of the ester mixture 赢创德固赛有限公司 2019-12-20 CN disclosed