SCHEMBL30974042

SCHEMBL30974042

CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 3/20 0.56
▸ NPY1R P25929 1/20 0.48
▸ NPY2R P49146 1/20 0.48
▸ NPY4R P50391 1/20 0.48
▸ ERAP2 Q6P179 1/20 0.46
▸ ERAP1 Q9NZ08 1/20 0.46
▸ LNPEP Q9UIQ6 1/20 0.46
▸ BACE1 P56817 9/20 0.46
▸ BACE2 Q9Y5Z0 2/20 0.46
▸ CTSD P07339 2/20 0.46
▸ DPP4 P27487 1/20 0.46
▸ DPP8 Q6V1X1 1/20 0.46
▸ DPP9 Q86TI2 1/20 0.46
▸ CPB2 Q96IY4 3/20 0.45
▸ OPRK1 P41145 1/20 0.44
▸ NMT2 O60551 1/20 0.43
▸ NMT1 P30419 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
SCHEMBL31097692 0.99 FOLH1 (0.58) FOLH1NPY1RNPY2RNPY4RERAP2
SCHEMBL31097742 0.99 FOLH1 (0.58) FOLH1NPY1RNPY2RNPY4RERAP2
SCHEMBL31097709 0.99 FOLH1 (0.58) FOLH1NPY1RNPY2RNPY4RERAP2
SCHEMBL31097730 0.99 FOLH1 (0.58) FOLH1NPY1RNPY2RNPY4RERAP2
SCHEMBL31097663 0.99 FOLH1 (0.58) FOLH1NPY1RNPY2RNPY4RERAP2
SCHEMBL30527886 0.99 FOLH1 (0.57) FOLH1NPY1RNPY2RNPY4RERAP2
SCHEMBL30527860 0.99 FOLH1 (0.57) FOLH1NPY1RNPY2RNPY4RERAP2
SCHEMBL30974028 0.96 FOLH1 (0.53) FOLH1NPY1RNPY2RNPY4RERAP2
SCHEMBL31097720 0.95 FOLH1 (0.56) FOLH1NPY1RNPY2RNPY4RERAP2
SCHEMBL31097691 0.95 FOLH1 (0.56) FOLH1NPY1RNPY2RNPY4RERAP2

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-2024132726-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE UNIWERSYTET GDANSKI (PL) 2024-06-27 — — WO claimed
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