SCHEMBL30636161

SCHEMBL30636161

N=C(N)NCCC[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 10/20 0.58
▸ GHSR Q92847 3/20 0.57
▸ NPY1R P25929 3/20 0.56
▸ NPY2R P49146 3/20 0.56
▸ NPY4R P50391 3/20 0.56
▸ KISS1R Q969F8 1/20 0.54

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
SCHEMBL29440486 1.00 NPBWR1 (0.58) NPBWR1GHSRNPY1RNPY2RNPY4R
SCHEMBL30669192 0.95 NPY1R (0.57) NPY1RNPY2RNPY4RKISS1R
SCHEMBL30092956 0.95 NPBWR1 (0.65) NPBWR1NPY1RNPY2RNPY4RKISS1R
SCHEMBL29641119 0.95 NPBWR1 (0.62) NPBWR1GHSRNPY1RNPY2RNPY4R
SCHEMBL29461961 0.95 NPBWR1 (0.62) NPBWR1GHSRNPY1RNPY2RNPY4R
SCHEMBL30919239 0.95 GHSR (0.61) NPBWR1GHSR
SCHEMBL30390841 0.95 NPY4R (0.58) NPBWR1NPY1RNPY2RNPY4RKISS1R
SCHEMBL30092995 0.94 IL23R (0.62) NPBWR1KISS1R
SCHEMBL29973185 0.94 KISS1R (0.60) NPBWR1KISS1R
SCHEMBL31661149 0.93 GHSR (0.61) GHSR

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-111094324-B Oncolytic virus, synthetic DNA sequence and application thereof 武汉博威德生物技术有限公司 2023-10-10 — — CN claimed
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