SCHEMBL14719925

SCHEMBL14719925

O=C(O)CC[C@H](NC(=O)N(O)CCCC[C@H](NC(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)O)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 17/20 0.60
CA2 P00918 3/20 0.47
CA1 P00915 2/20 0.47
CA12 O43570 1/20 0.47
CA9 Q16790 1/20 0.47

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
SCHEMBL14719857 0.94 FOLH1 (0.62) FOLH1CA2CA1CA12CA9
SCHEMBL14719929 0.81 ALB (0.51) FOLH1CA2CA1CA12CA9
SCHEMBL14719923 0.79 FOLH1 (0.89) FOLH1
SCHEMBL22712902 0.79 FOLH1 (0.89) FOLH1
SCHEMBL18161521 0.79 FOLH1 (0.89) FOLH1
SCHEMBL18145376 0.79 FOLH1 (0.89) FOLH1
SCHEMBL16446810 0.77 FOLH1 (0.67) FOLH1CA2CA1
SCHEMBL16446811 0.77 FOLH1 (0.67) FOLH1CA2CA1
SCHEMBL14729306 0.75 FOLH1 (1.00) FOLH1CA2
SCHEMBL2244716 0.75 FOLH1 (0.60) FOLH1CA2CA1CA12CA9

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-2013028664-A1 PSMA IMAGING AGENTS SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2013-02-28 WO disclosed