SCHEMBL29627780

SCHEMBL29627780

N=C(N)NCCC[C@H](NC(=O)CN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 1/20 0.42
QRFPR Q96P65 1/20 0.40
NPY4R P50391 8/20 0.39
NPY5R Q15761 7/20 0.39
NPY1R P25929 6/20 0.39
NPY2R P49146 4/20 0.39
NMT2 O60551 2/20 0.39
NMT1 P30419 2/20 0.39
MME P08473 2/20 0.37
TLR2 O60603 1/20 0.37
SLC15A2 Q16348 1/20 0.36
SIRT5 Q9NXA8 1/20 0.36

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
SCHEMBL29777440 0.95 GNPAT (0.44) GNPATQRFPRNPY4RNPY5RNPY1R
SCHEMBL17440322 0.95 QRFPR (0.42) GNPATQRFPRNPY4RNPY5RNPY1R
SCHEMBL13319653 0.95 QRFPR (0.42) GNPATQRFPRNPY4RNPY5RNPY1R
SCHEMBL31064851 0.94 GNPAT (0.44) GNPATNPY4RNPY5RNPY1RNPY2R
SCHEMBL29678881 0.94 QRFPR (0.42) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL30202138 0.93 GNPAT (0.42) GNPATNPY4RNPY5RNPY1RNPY2R
SCHEMBL29485126 0.93 GNPAT (0.48) GNPATNPY4RNPY5RNPY1RNPY2R
SCHEMBL29630364 0.93 NMT1 (0.44) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL30711719 0.93 NMT1 (0.44) QRFPRNPY4RNPY5RNPY1RNPY2R
SCHEMBL10531786 0.92 QRFPR (0.40) GNPATQRFPRNPY4RNPY5RNPY1R

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-11312942-B2 Material-fixing substrate and method for producing same, and material-fixing agent used for material-fixing substrate SONY CORPORATION (JP) 2022-04-26 US disclosed