SCHEMBL8088720

SCHEMBL8088720

CCCCCCCCCCCCN(C(C)=O)C(=O)C(O)CC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.36
FFAR1 O14842 1/20 0.36
EPHX1 P07099 1/20 0.36
MEN1 O00255 1/20 0.34
FAAH O00519 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
SOAT1 P35610 1/20 0.34
KMT2A Q03164 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
SCHEMBL8670068 0.78 GPR84 (0.39) GPR84FFAR1MEN1FAAHKMT2A
SCHEMBL21827488 0.77 CA12 (0.40) GPR84FFAR1
SCHEMBL2484241 0.75 DNM1 (0.46) GPR84FFAR1MEN1KMT2A
SCHEMBL15334858 0.75 DNM1 (0.46) GPR84FFAR1MEN1KMT2A
SCHEMBL9550793 0.75 DNM1 (0.46) GPR84FFAR1MEN1KMT2A
SCHEMBL1671981 0.75 DNM1 (0.46) GPR84FFAR1MEN1KMT2A
SCHEMBL2484947 0.75 DNM1 (0.46) GPR84FFAR1MEN1KMT2A
SCHEMBL28968204 0.75 DNM1 (0.46) GPR84FFAR1MEN1KMT2A
SCHEMBL24072544 0.73 FFAR4 (0.37) GPR84FFAR1EPHX1
SCHEMBL1940546 0.73 CES1 (0.42) GPR84FFAR1MEN1KMT2A

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
JP-2000034261-A PRODUCTION OF MALIC ACID MONOAMIDE LION CORP 2000-02-02 JP disclosed