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Sugi Predict / Compounds / SCHEMBL18717200

SCHEMBL18717200

SCHEMBL18717200

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

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 5/20 0.54
▸ IL23R Q5VWK5 14/20 0.53
▸ KISS1R Q969F8 1/20 0.51
▸ NPFFR1 Q9GZQ6 1/20 0.51

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
SCHEMBL19473851 0.96 IL23R (0.57) MC4RIL23R
SCHEMBL18717065 0.96 MC4R (0.53) MC4RIL23RKISS1RNPFFR1
SCHEMBL18716912 0.94 MC4R (0.58) MC4RIL23R
SCHEMBL18717197 0.93 KISS1R (0.54) MC4RIL23RKISS1RNPFFR1
SCHEMBL18716898 0.92 MC4R (0.56) MC4RIL23R
SCHEMBL18716989 0.92 MC4R (0.56) MC4RIL23R
SCHEMBL18717198 0.92 MC4R (0.53) MC4RIL23RKISS1RNPFFR1
SCHEMBL19474019 0.92 IL23R (0.57) MC4RIL23RKISS1R
SCHEMBL18716871 0.91 MC4R (0.50) MC4RIL23RKISS1RNPFFR1
SCHEMBL18717179 0.89 IL23R (0.58) MC4RIL23R

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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