SCHEMBL28638778

SCHEMBL28638778

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

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 11/20 0.41
▸ NPY1R P25929 6/20 0.41
▸ NPY2R P49146 4/20 0.41
▸ NPY5R Q15761 4/20 0.41
▸ KISS1R Q969F8 4/20 0.38
▸ OPRM1 P35372 1/20 0.37
▸ CTSL P07711 1/20 0.37
▸ IL23R Q5VWK5 1/20 0.36
▸ OPRL1 P41146 2/20 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
SCHEMBL28638783 1.00 NPY4R (0.41) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL28645300 0.92 OPRM1 (0.43) NPY4RNPY1RNPY2RNPY5ROPRM1
SCHEMBL28645296 0.92 OPRM1 (0.43) NPY4RNPY1RNPY2RNPY5ROPRM1
SCHEMBL28637450 0.86 OPRM1 (0.45) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL28637452 0.86 OPRM1 (0.45) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL22117542 0.84 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL22117843 0.84 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL22117841 0.84 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL22117540 0.84 NPY4R (0.47) NPY4RNPY1RNPY2RNPY5RKISS1R
SCHEMBL31679033 0.84 CTSL (0.48) NPY4RNPY1RNPY2RNPY5RKISS1R

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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