SCHEMBL20179209

SCHEMBL20179209

CC(C)NC(=O)ONC(=O)CCC(C=O)Cc1cccc(C(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 9/20 0.42
ANPEP P15144 1/20 0.40
ENPEP Q07075 1/20 0.40
F10 P00742 1/20 0.39
SLC7A5 Q01650 1/20 0.38
MEP1B Q16820 3/20 0.38
MRGPRX4 Q96LA9 1/20 0.37

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
SCHEMBL26038895 0.88 FOLH1 (0.45) FOLH1ANPEPENPEPF10SLC7A5
SCHEMBL26038893 0.87 FOLH1 (0.44) FOLH1ANPEPENPEPSLC7A5MEP1B
SCHEMBL21578045 0.87 FOLH1 (0.45) FOLH1ANPEPENPEPF10SLC7A5
SCHEMBL20179162 0.85 FOLH1 (0.54) FOLH1ANPEPENPEPSLC7A5
SCHEMBL20179169 0.85 FOLH1 (0.43) FOLH1ANPEPENPEPSLC7A5MEP1B
SCHEMBL20179164 0.85 ANPEP (0.43) FOLH1ANPEPENPEPSLC7A5MEP1B
SCHEMBL26038897 0.84 FOLH1 (0.44) FOLH1ANPEPENPEPSLC7A5MEP1B
SCHEMBL20179208 0.84 FOLH1 (0.43) FOLH1ANPEPENPEPSLC7A5MRGPRX4
SCHEMBL20179257 0.83 ANPEP (0.42) FOLH1ANPEPENPEPSLC7A5MEP1B
SCHEMBL26039018 0.81 FOLH1 (0.40) FOLH1ANPEPENPEPF10SLC7A5

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-2018094334-A1 PRODRUGS OF HYDROXAMATE-BASED GCPII INHIBITORS THE JOHNS HOPKINS UNIVERSITY (US) 2018-05-24 WO disclosed