SCHEMBL20179265

SCHEMBL20179265

C=CCC[C@@H](Cc1cccc(-c2cccc(C(=O)O)c2)c1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 11/20 0.59
KMO O15229 1/20 0.44
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43

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
SCHEMBL20179250 1.00 FOLH1 (0.59) FOLH1KMOFNTAFNTB
SCHEMBL20168741 1.00 FOLH1 (0.59) FOLH1KMOFNTAFNTB
SCHEMBL21577999 0.92 FOLH1 (0.68) FOLH1
SCHEMBL14508892 0.92 FOLH1 (0.68) FOLH1
SCHEMBL20168567 0.92 FOLH1 (0.68) FOLH1
SCHEMBL21578011 0.85 FOLH1 (0.46) FOLH1KMOFNTAFNTB
SCHEMBL21570577 0.84 FOLH1 (0.49) FOLH1FNTAFNTB
SCHEMBL20168766 0.84 FOLH1 (0.49) FOLH1FNTAFNTB
SCHEMBL5054784 0.81 FOLH1 (0.85) FOLH1FNTAFNTB
SCHEMBL15247509 0.79 CYP1A2 (0.63) FOLH1

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