SCHEMBL31737281

SCHEMBL31737281

CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CXCR4 P61073 10/20 0.55
▸ MC4R P32245 2/20 0.53
▸ MC5R P33032 2/20 0.53
▸ MC3R P41968 2/20 0.53
▸ MC1R Q01726 2/20 0.53
▸ NTSR2 O95665 1/20 0.52
▸ NTSR1 P30989 1/20 0.52
▸ SORT1 Q99523 1/20 0.52
▸ IL23R Q5VWK5 1/20 0.50
▸ C5AR1 P21730 1/20 0.50
▸ DPP3 Q9NY33 2/20 0.49
▸ TACR1 P25103 1/20 0.49

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
SCHEMBL29556676 0.95 CXCR4 (0.55) CXCR4MC4RMC5RMC3RMC1R
SCHEMBL13880088 0.93 MC4R (0.54) CXCR4MC4RMC5RMC3RMC1R
SCHEMBL29973187 0.92 CXCR4 (0.56) CXCR4MC4RMC5RMC3RMC1R
SCHEMBL29533433 0.89 MC4R (0.62) CXCR4MC4RMC5RMC3RMC1R
SCHEMBL18116804 0.89 NTSR2 (0.54) CXCR4MC4RMC5RMC3RMC1R
SCHEMBL31191176 0.85 C5AR1 (0.64) CXCR4MC4RMC5RMC3RMC1R
SCHEMBL31650786 0.83 MC4R (0.64) CXCR4MC4RMC5RMC3RMC1R
SCHEMBL16455572 0.83 MC4R (0.65) CXCR4MC4RMC5RMC3RMC1R
SCHEMBL31689356 0.83 DPP3 (0.57) CXCR4NTSR2NTSR1SORT1C5AR1
SCHEMBL31127569 0.83 NTSR2 (0.54) CXCR4NTSR2NTSR1SORT1C5AR1

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
WO-2025245292-A1 NON-NATURALLY OCCURRING MELANOCORTIN RECEPTOR AGONISTS AND USES THEREOF FOR MODULATING WEIGHT LOSS ENDEVICA BIO, INC. (US) 2025-11-27 — — WO disclosed
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