SCHEMBL20179257

SCHEMBL20179257

O=CC(CCC(=O)NOC(=O)Cc1ccccc1)Cc1cccc(C(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.42
ENPEP Q07075 1/20 0.42
FOLH1 Q04609 8/20 0.41
MEP1B Q16820 3/20 0.39
SLC7A5 Q01650 2/20 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
SCHEMBL20179169 0.89 FOLH1 (0.43) ANPEPENPEPFOLH1MEP1BSLC7A5
SCHEMBL20179164 0.89 ANPEP (0.43) ANPEPENPEPFOLH1MEP1BSLC7A5
SCHEMBL26038893 0.89 FOLH1 (0.44) ANPEPENPEPFOLH1MEP1BSLC7A5
SCHEMBL26038895 0.85 FOLH1 (0.45) ANPEPENPEPFOLH1MEP1BSLC7A5
SCHEMBL21577908 0.85 FOLH1 (0.44) ANPEPENPEPFOLH1MEP1BSLC7A5
SCHEMBL20179193 0.85 FOLH1 (0.56) ANPEPENPEPFOLH1
SCHEMBL26038897 0.84 FOLH1 (0.44) ANPEPENPEPFOLH1MEP1BSLC7A5
SCHEMBL20179209 0.83 FOLH1 (0.42) ANPEPENPEPFOLH1MEP1BSLC7A5
SCHEMBL20179208 0.83 FOLH1 (0.43) ANPEPENPEPFOLH1SLC7A5
SCHEMBL20168307 0.79 FOLH1 (0.51) ANPEPENPEPFOLH1SLC7A5

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