SCHEMBL20168567

SCHEMBL20168567

C=CCC[C@H](Cc1cccc(C(=O)O)c1)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 14/20 0.68
ANPEP P15144 1/20 0.49
ENPEP Q07075 1/20 0.49

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
SCHEMBL21577999 1.00 FOLH1 (0.68) FOLH1ANPEPENPEP
SCHEMBL14508892 1.00 FOLH1 (0.68) FOLH1ANPEPENPEP
SCHEMBL20179250 0.92 FOLH1 (0.59) FOLH1
SCHEMBL20168741 0.92 FOLH1 (0.59) FOLH1
SCHEMBL20179265 0.92 FOLH1 (0.59) FOLH1
SCHEMBL15247509 0.84 CYP1A2 (0.63) FOLH1
SCHEMBL12418042 0.84 CYP1A2 (0.63) FOLH1
SCHEMBL21578000 0.83 FOLH1 (0.50) FOLH1ANPEPENPEP
SCHEMBL20168665 0.83 FOLH1 (0.56) FOLH1ANPEPENPEP
SCHEMBL21570560 0.83 FOLH1 (0.56) FOLH1ANPEPENPEP

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