SCHEMBL29808232

SCHEMBL29808232

CC(C)C[C@H](NC(=O)CN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O)[C@@H](C)O)[C@@H](C)O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 5/20 0.46
▸ GLP1R P43220 3/20 0.46
▸ SCTR P47872 1/20 0.46
▸ CALCR P30988 4/20 0.46
▸ OPRM1 P35372 1/20 0.45
▸ OPRD1 P41143 1/20 0.45
▸ OPRK1 P41145 1/20 0.45
▸ F2 P00734 4/20 0.45
▸ HCRTR1 O43613 1/20 0.45
▸ HCRTR2 O43614 1/20 0.45
▸ CRHR1 P34998 1/20 0.45
▸ CRHR2 Q13324 1/20 0.45
▸ VIPR1 P32241 1/20 0.44

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
SCHEMBL29986177 0.91 OPRM1 (0.52) KISS1RGLP1RSCTROPRM1OPRD1
SCHEMBL30728852 0.91 OPRM1 (0.52) KISS1RGLP1RSCTROPRM1OPRD1
SCHEMBL30973951 0.88 GLP1R (0.53) GLP1RSCTRCALCROPRM1OPRD1
SCHEMBL31412207 0.88 OPRD1 (0.46) KISS1RGLP1RSCTROPRD1
SCHEMBL31410862 0.86 TFPI (0.47) GLP1RSCTRCALCRVIPR1
SCHEMBL30065734 0.86 OPRM1 (0.48) OPRM1OPRD1OPRK1F2
SCHEMBL30728853 0.86 OPRM1 (0.48) OPRM1OPRD1OPRK1F2
SCHEMBL31005062 0.86 GLP1R (0.55) GLP1RSCTRCALCROPRM1OPRD1
SCHEMBL29597233 0.85 OPRM1 (0.56) GLP1RSCTRCALCROPRM1OPRD1
SCHEMBL29597500 0.85 OPRM1 (0.56) GLP1RSCTRCALCROPRM1OPRD1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109476703-B Novel peptides and uses thereof 学校法人芝浦工业大学 2022-09-20 — — CN claimed
CN-109312369-B Virus composition and method for isolation using the same 学校法人芝浦工业大学 2022-08-23 — — CN claimed
CN-109476703-B Novel peptides and uses thereof 学校法人芝浦工业大学 2022-09-20 — — CN disclosed
CN-109312369-B Virus composition and method for isolation using the same 学校法人芝浦工业大学 2022-08-23 — — CN disclosed
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