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SCHEMBL18556705

SCHEMBL18556705

CC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 3/20 0.63
▸ OPRM1 P35372 2/20 0.63
▸ KISS1R Q969F8 2/20 0.57
▸ CCKBR P32239 12/20 0.57
▸ CCKAR P32238 2/20 0.56
▸ ECE1 P42892 2/20 0.53
▸ NPBWR1 P48145 1/20 0.53

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
SCHEMBL18556752 0.88 CTSL (0.52) OPRD1OPRM1KISS1RCCKBRECE1
SCHEMBL18556712 0.87 KISS1R (0.55) OPRD1OPRM1KISS1RCCKBRCCKAR
SCHEMBL29564479 0.86 OPRD1 (0.61) OPRD1OPRM1KISS1RCCKBRCCKAR
SCHEMBL31070800 0.85 OPRD1 (0.58) OPRD1OPRM1CCKBRCCKARECE1
SCHEMBL31483647 0.83 OPRD1 (0.60) OPRD1OPRM1CCKBRCCKARECE1
SCHEMBL31252909 0.83 OPRM1 (0.62) OPRD1OPRM1KISS1RCCKBRNPBWR1
SCHEMBL18556748 0.82 CCKBR (0.64) OPRD1KISS1RCCKBRCCKARNPBWR1
SCHEMBL18556702 0.82 CCKBR (0.61) OPRD1KISS1RCCKBRCCKARNPBWR1
SCHEMBL20363004 0.82 CCKBR (0.57) OPRD1OPRM1KISS1RCCKBRCCKAR
SCHEMBL18556704 0.82 OPRM1 (0.49) OPRD1OPRM1KISS1RECE1

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
US-9580466-B2 Melanocortin-1 receptor-specific linear peptides PALATIN TECHNOLOGIES, INC. (US) 2017-02-28 — — US disclosed
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