SCHEMBL5354110

SCHEMBL5354110

CSCCC(N)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(CCCCN)C(=O)NC(C(=O)NC(CCC(=O)O)C(=O)O)C(C)O

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 13/20 0.46
▸ FOLH1 Q04609 4/20 0.45
▸ BACE2 Q9Y5Z0 2/20 0.45
▸ CTSD P07339 3/20 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
SCHEMBL5354118 1.00 BACE1 (0.46) BACE1FOLH1BACE2CTSD
SCHEMBL30401136 0.93 FOLH1 (0.51) BACE1FOLH1BACE2CTSD
SCHEMBL30194119 0.89 BACE1 (0.47) BACE1FOLH1BACE2CTSD
SCHEMBL29571467 0.89 BACE1 (0.46) BACE1FOLH1BACE2CTSD
SCHEMBL31232452 0.89 FOLH1 (0.47) BACE1FOLH1BACE2CTSD
SCHEMBL31753464 0.88 FOLH1 (0.53) FOLH1
SCHEMBL30681789 0.88 BACE1 (0.46) BACE1FOLH1BACE2CTSD
SCHEMBL30681783 0.88 BACE1 (0.46) BACE1FOLH1BACE2CTSD
SCHEMBL30400254 0.87 FOLH1 (0.54) FOLH1
SCHEMBL10336059 0.87 BACE1 (0.51) BACE1FOLH1BACE2CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7211431-B2 Expression cassettes for producing plants with increased levels of essential amino acids PIONEER HI-BRED INTERNATIONAL, INC. (US) 2007-05-01 — — US disclosed
US-20050010973-A1 Proteins with increased levels of essential amino acids PIONEER HI-BRED INTERNATIONAL, INC. 2005-01-13 — — US disclosed
US-6800726-B1 DERIVED FROM PROTEASE/CHYMOTRYPSIN INHIBITOR IN PLANTS; FOR FEED/FOODS; NUTRACEUTICALS PIONEER HI-BRED INTERNATIONAL, INC. 2004-10-05 — — US disclosed
EP-0946729-A2 PROTEINS WITH ENHANCED LEVELS OF ESSENTIAL AMINO ACIDS PIONEER HI-BRED INTERNATIONAL, INC. (US) 1999-10-06 — — EP disclosed
WO-1998020133-A2 PROTEINS WITH ENHANCED LEVELS OF ESSENTIAL AMINO ACIDS PIONEER HI-BRED INTERNATIONAL, INC. (US) 1998-05-14 — — WO disclosed
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