SCHEMBL9346926

SCHEMBL9346926

O=C(O)CCC(NF)C(=O)NC(Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NAALAD2 Q9Y3Q0 3/20 0.71
▸ FOLH1 Q04609 5/20 0.54
▸ MME P08473 5/20 0.53
▸ ACE P12821 7/20 0.52
▸ CPA1 P15085 1/20 0.52
▸ ACE2 Q9BYF1 1/20 0.52

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
SCHEMBL12698845 0.87 NAALAD2 (0.68) NAALAD2FOLH1MMEACECPA1
SCHEMBL29854515 0.85 NAALAD2 (0.68) NAALAD2FOLH1MMEACECPA1
SCHEMBL29854480 0.85 NAALAD2 (0.68) NAALAD2FOLH1MMEACECPA1
SCHEMBL16486435 0.85 NAALAD2 (0.68) NAALAD2FOLH1MMEACECPA1
SCHEMBL16486437 0.85 NAALAD2 (0.68) NAALAD2FOLH1MMEACECPA1
SCHEMBL11036773 0.84 NAALAD2 (0.67) NAALAD2FOLH1MMEACECPA1
SCHEMBL31610861 0.84 NAALAD2 (0.67) NAALAD2FOLH1MMEACECPA1
SCHEMBL4316981 0.83 NAALAD2 (1.00) NAALAD2FOLH1
SCHEMBL13515316 0.83 NAALAD2 (1.00) NAALAD2FOLH1
SCHEMBL9965331 0.83 NAALAD2 (1.00) NAALAD2FOLH1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0608217-A1 SOLUBLE AND STABLE SOURCES OF TYROSINE, CYSTEINE AND GLUTAMINE FOR TOTAL PARENTERAL NUTRITION RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1994-08-03 — — EP claimed
EP-0608217-A4 SOLUBLE AND STABLE SOURCES OF TYROSINE, CYSTEINE AND GLUTAMINE FOR TOTAL PARENTERAL NUTRITION. RES CORP TECHNOLOGIES INC (US) 1993-12-06 — — EP claimed
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