SCHEMBL7514962

SCHEMBL7514962

CC(N)(C(=O)O)C(=O)CCCO

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CAMK2A Q9UQM7 1/20 0.42
ARG2 P78540 3/20 0.35
GPR84 Q9NQS5 1/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
ARG1 P05089 2/20 0.33
ALDH1A1 P00352 2/20 0.32
GGT1 P19440 1/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
THRB P10828 1/20 0.32
KMT2A Q03164 1/20 0.32
PPARA Q07869 1/20 0.32
TSHR P16473 2/20 0.31
FAAH O00519 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 1/20 0.30

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
SCHEMBL3803860 0.83 FAAH (0.43) GPR84FFAR1FFAR4ALDH1A1MEN1
SCHEMBL5473167 0.81 FAAH (0.52) GPR84FFAR1FFAR4ALDH1A1MEN1
SCHEMBL27809919 0.79 FAAH (0.53) GPR84FFAR1FFAR4ALDH1A1MEN1
SCHEMBL27606031 0.79 FAAH (0.53) GPR84FFAR1FFAR4ALDH1A1MEN1
SCHEMBL27455275 0.79 FAAH (0.53) GPR84FFAR1FFAR4ALDH1A1MEN1
SCHEMBL27778113 0.79 FAAH (0.53) GPR84FFAR1FFAR4ALDH1A1MEN1
SCHEMBL27518625 0.79 FAAH (0.53) GPR84FFAR1FFAR4ALDH1A1MEN1
SCHEMBL27499818 0.79 FAAH (0.53) GPR84FFAR1FFAR4ALDH1A1MEN1
SCHEMBL27499819 0.79 FAAH (0.53) GPR84FFAR1FFAR4ALDH1A1MEN1
SCHEMBL27545228 0.78 FAAH (0.52) GPR84FFAR1FFAR4ALDH1A1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1073633-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 2001-02-07 EP claimed
WO-1999057098-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 1999-11-11 WO claimed