SCHEMBL8526417

SCHEMBL8526417

CCCCCCCCCCC([C]=O)NC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
GPR84 Q9NQS5 7/20 0.46
FFAR1 O14842 2/20 0.46
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
FFAR4 Q5NUL3 1/20 0.42
ACE2 Q9BYF1 1/20 0.42
ZDHHC7 Q9NXF8 1/20 0.41
FAAH O00519 1/20 0.41
HSPD1 P10809 1/20 0.39
BLM P54132 1/20 0.39
HSPE1 P61604 1/20 0.39
NOD1 Q9Y239 1/20 0.39
PLA2G2C Q5R387 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
SCHEMBL109296 0.85 PLA2G2C (0.45) MAPTGPR84FFAR1LCKPPARD
SCHEMBL15283647 0.84 GPR84 (0.44) MAPTGPR84FFAR1LCKPPARD
SCHEMBL18425829 0.81 MAPT (0.41) MAPTGPR84FFAR1LCKPPARD
SCHEMBL8597199 0.79 SPHK1 (0.38) MAPTGPR84FFAR1LCKPPARD
SCHEMBL1649294 0.77 PLA2G2C (0.44) PLA2G2C
SCHEMBL4323327 0.77 PLA2G2C (0.44) PLA2G2C
SCHEMBL10384273 0.76 SPHK1 (0.35) MAPTGPR84FFAR1ZDHHC7
SCHEMBL5012513 0.76 PLA2G2C (0.56) MAPTGPR84FFAR1LCKPPARD
SCHEMBL20459159 0.76 PLA2G2C (0.56) MAPTGPR84FFAR1LCKPPARD
SCHEMBL9853678 0.76 MAPT (0.41) MAPTGPR84FFAR1LCKPPARD

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
US-5998368-A Derivatives of structurally modified VIP and pharmaceutical compositions containing them YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 1999-12-07 US disclosed