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SCHEMBL18716871

SCHEMBL18716871

CNC(=N)NCCC[C@@H](C=O)NC(=O)C(Cc1ccccc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)C(CCC(=O)NCCCC(NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC)C(=O)O)NC(=O)CNC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 6/20 0.50
▸ CCKAR P32238 4/20 0.48
▸ CCKBR P32239 4/20 0.48
▸ IL23R Q5VWK5 7/20 0.48
▸ NPBWR1 P48145 1/20 0.48
▸ KISS1R Q969F8 2/20 0.47
▸ NPFFR1 Q9GZQ6 1/20 0.47

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
SCHEMBL18717200 0.91 MC4R (0.54) MC4RIL23RKISS1RNPFFR1
SCHEMBL18717065 0.90 MC4R (0.53) MC4RIL23RKISS1RNPFFR1
SCHEMBL18716912 0.89 MC4R (0.58) MC4RIL23R
SCHEMBL18716898 0.88 MC4R (0.56) MC4RIL23R
SCHEMBL19473851 0.87 IL23R (0.57) MC4RIL23R
SCHEMBL18716989 0.86 MC4R (0.56) MC4RIL23R
SCHEMBL18717198 0.86 MC4R (0.53) MC4RIL23RKISS1RNPFFR1
SCHEMBL18717197 0.85 KISS1R (0.54) MC4RIL23RKISS1RNPFFR1
SCHEMBL19473901 0.84 IL23R (0.50) MC4RIL23RNPBWR1
SCHEMBL18716922 0.83 MC4R (0.55) MC4RIL23RKISS1RNPFFR1

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
EP-2440572-B1 LACTAM-BRIDGED MELANOCORTIN RECEPTOR-SPECIFIC PEPTIDES PALATIN TECHNOLOGIES INC (US) 2017-04-05 — — EP disclosed
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