SCHEMBL29630370

SCHEMBL29630370

N=C(N)NCCC[C@H](N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPY4R P50391 9/20 0.41
NPY1R P25929 5/20 0.41
NPY2R P49146 4/20 0.41
NPY5R Q15761 4/20 0.41
NOD1 Q9Y239 3/20 0.39
OPRM1 P35372 3/20 0.37
OPRD1 P41143 3/20 0.37
OPRK1 P41145 1/20 0.37
PTGS1 P23219 1/20 0.37
GSTK1 Q9Y2Q3 1/20 0.37
QRFPR Q96P65 1/20 0.36
PRMT1 Q99873 1/20 0.36
TGFBR1 P36897 1/20 0.35

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
SCHEMBL29391114 0.94 NOD1 (0.44) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL34464591 0.92 QRFPR (0.42) NPY4RNPY1RNPY2RNPY5RQRFPR
SCHEMBL30567417 0.92 NOD1 (0.42) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL30193233 0.92 NMT1 (0.44) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL30786580 0.92 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5ROPRM1
SCHEMBL29591553 0.91 NPY4R (0.41) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL27086399 0.90 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL27086388 0.90 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL6237668 0.90 NPY4R (0.45) NPY4RNPY1RNPY2RNPY5RNOD1
SCHEMBL13655536 0.90 NMT1 (0.43) NPY4RNPY1RNPY2RNPY5R

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
US-11807899-B2 Biochemical reaction methods and reagents comprising intrinsically disordered regions Biocrucible Limited 2023-11-07 US disclosed
US-20220145378-A1 BIOCHEMICAL REACTION METHODS AND REAGENTS COMPRISING INTRINSICALLY DISORDERED REGIONS Biocrucible Limited (GB) 2022-05-12 US disclosed