SCHEMBL29534172

SCHEMBL29534172

CSCC[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 3/20 0.78
▸ MC5R P33032 2/20 0.78
▸ MC3R P41968 2/20 0.78
▸ MC1R Q01726 2/20 0.78
▸ C5AR1 P21730 2/20 0.71
▸ CTSL P07711 3/20 0.67
▸ CTSS P25774 3/20 0.67
▸ CTSK P43235 3/20 0.67
▸ CTSH P09668 1/20 0.67
▸ CXCL8 P10145 6/20 0.63
▸ GLP1R P43220 4/20 0.63
▸ IL23R Q5VWK5 1/20 0.63
▸ GCGR P47871 3/20 0.60

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
Intermedine SCHEMBL20548027 0.98 MC4R (0.82) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29358645 0.98 MC4R (0.82) MC4RMC5RMC3RMC1RC5AR1
Intermedine SCHEMBL22076809 0.98 MC4R (0.82) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29533861 0.96 C5AR1 (0.74) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29970570 0.96 MC4R (0.77) MC4RMC5RMC3RMC1RC5AR1
Alsactide SCHEMBL29406207 0.95 C5AR1 (0.74) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29973172 0.94 C5AR1 (0.77) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29430238 0.94 MC4R (0.78) MC4RMC5RMC3RMC1RC5AR1
SCHEMBL29533733 0.94 MC4R (0.78) MC4RMC5RMC3RMC1RC5AR1
Giractide SCHEMBL29387618 0.94 MC4R (0.75) MC4RMC5RMC3RMC1RC5AR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115279390-A Reverse amide linked melanotropin receptor specific cyclic peptides 帕拉丁科技公司 2022-11-01 — — CN disclosed
US-20220133839-A1 PEPTIDE ANALOGUES WITH BRANCHED AMINO ACID PROBE(S) TXP PHARMA GMBH (CH) 2022-05-05 — — US disclosed
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