SCHEMBL28645296

SCHEMBL28645296

N=C(N)NCCC[C@H](CN[C@@H](CC1CCOCC1)C(=O)N[C@@H](CCCCN)C(N)=O)NC(=O)[C@@H](N)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 7/20 0.43
▸ NPY4R P50391 6/20 0.42
▸ NPY1R P25929 4/20 0.42
▸ NPY2R P49146 4/20 0.42
▸ NPY5R Q15761 4/20 0.42
▸ OPRL1 P41146 3/20 0.42
▸ OPRD1 P41143 1/20 0.41
▸ OPRK1 P41145 6/20 0.41
▸ IL23R Q5VWK5 1/20 0.40

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
SCHEMBL28645300 1.00 OPRM1 (0.43) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL28637450 0.94 OPRM1 (0.45) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL28637452 0.94 OPRM1 (0.45) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL22117843 0.93 NPY4R (0.47) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL22117841 0.93 NPY4R (0.47) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL28638783 0.92 NPY4R (0.41) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL28638778 0.92 NPY4R (0.41) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL28652449 0.88 NPY4R (0.46) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL28652444 0.88 NPY4R (0.46) OPRM1NPY4RNPY1RNPY2RNPY5R
SCHEMBL22117542 0.86 NPY4R (0.47) OPRM1NPY4RNPY1RNPY2RNPY5R

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
CN-113544138-A Mitochondrial targeting peptides 隐形生物治疗公司 2021-10-22 — — CN disclosed
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