SCHEMBL19442889

SCHEMBL19442889

O=C(O)CC[C@H](NC(=O)N[C@@H](CCCCNC(=O)Nc1ccc(CC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)O)cc1)C(=O)O)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 20/20 0.61

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
SCHEMBL15739353 0.99 FOLH1 (0.62) FOLH1
SCHEMBL17191787 0.93 FOLH1 (0.63) FOLH1
SCHEMBL18800214 0.91 FOLH1 (0.61) FOLH1
SCHEMBL15739441 0.90 FOLH1 (0.62) FOLH1
SCHEMBL23720591 0.90 FOLH1 (0.59) FOLH1
SCHEMBL15739424 0.90 FOLH1 (0.58) FOLH1
SCHEMBL18800212 0.89 FOLH1 (0.57) FOLH1
SCHEMBL22958166 0.88 FOLH1 (0.57) FOLH1
SCHEMBL21478125 0.88 FOLH1 (0.57) FOLH1
SCHEMBL18311329 0.87 FOLH1 (0.58) 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
US-9782493-B2 Conjugates for treating diseases caused by PSMA expressing cells ENDOCYTE, INC. (US) 2017-10-10 — — US disclosed
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