SCHEMBL7991055

SCHEMBL7991055

C=CCCCC(CC(=O)OC(C)(C)C)C(=O)N1C(=O)OCC1Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.39
PPARA Q07869 1/20 0.38
IL6ST P40189 1/20 0.37
FAAH O00519 8/20 0.37
MGLL Q99685 3/20 0.37
PLA2G10 O15496 1/20 0.35
PLA2G5 P39877 1/20 0.35
NAAA Q02083 1/20 0.35
KLK7 P49862 1/20 0.35
KLK5 Q9Y337 1/20 0.35
REN P00797 3/20 0.34
ABCB1 P08183 1/20 0.33

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
SCHEMBL7991050 1.00 USP2 (0.39) USP2PPARAIL6STFAAHMGLL
SCHEMBL12744694 0.97 USP2 (0.38) USP2PPARAIL6STFAAHMGLL
SCHEMBL8828150 0.92 PPARA (0.39) USP2PPARAIL6STFAAHPLA2G10
SCHEMBL2192756 0.90 USP2 (0.46) USP2PPARAIL6STFAAHPLA2G10
SCHEMBL22036316 0.90 USP2 (0.46) USP2PPARAIL6STFAAHPLA2G10
SCHEMBL2192762 0.90 USP2 (0.46) USP2PPARAIL6STFAAHPLA2G10
SCHEMBL2192757 0.90 USP2 (0.46) USP2PPARAIL6STFAAHPLA2G10
SCHEMBL7049082 0.90 USP2 (0.46) USP2PPARAIL6STFAAHPLA2G10
SCHEMBL15619032 0.90 USP2 (0.46) USP2PPARAIL6STFAAHPLA2G10
SCHEMBL12418054 0.90 USP2 (0.46) USP2PPARAIL6STFAAHPLA2G10

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
WO-2001040198-A2 MACROCYCLIC HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTIMICROBIAL AGENTS AVENTIS PHARMA S.A. (FR) 2001-06-07 WO disclosed