SCHEMBL29511006

SCHEMBL29511006

N=C(N)NCCC[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](N)CS)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 1/20 0.52
▸ MC4R P32245 2/20 0.50
▸ KISS1R Q969F8 2/20 0.49
▸ CTSL P07711 3/20 0.49
▸ CTSS P25774 3/20 0.49
▸ CTSK P43235 3/20 0.49
▸ CTSH P09668 1/20 0.49
▸ IL23R Q5VWK5 5/20 0.48
▸ CCKAR P32238 1/20 0.47
▸ CCKBR P32239 1/20 0.47
▸ OPRD1 P41143 1/20 0.47
▸ NPBWR1 P48145 1/20 0.47
▸ GLP1R P43220 1/20 0.47
▸ PRMT1 Q99873 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
SCHEMBL30264772 0.98 C5AR1 (0.51) C5AR1MC4RKISS1RCTSLCTSS
SCHEMBL29476562 0.95 MC4R (0.50) C5AR1MC4RKISS1R
SCHEMBL29476617 0.95 MC4R (0.50) C5AR1MC4RKISS1R
SCHEMBL29511100 0.94 C5AR1 (0.51) C5AR1MC4RKISS1RCTSLCTSS
SCHEMBL30725657 0.94 C5AR1 (0.52) C5AR1MC4RIL23RNPBWR1GLP1R
SCHEMBL29511047 0.93 C5AR1 (0.50) C5AR1MC4RCCKBR
SCHEMBL30510423 0.91 TUBB4A (0.52) C5AR1MC4RKISS1RCTSLCTSS
SCHEMBL29476494 0.91 TUBB4A (0.52) C5AR1MC4RKISS1RCTSLCTSS
SCHEMBL30518049 0.91 C5AR1 (0.53) C5AR1MC4RKISS1RCTSLCTSS
SCHEMBL30264643 0.91 IL23R (0.54) MC4RKISS1RIL23RNPBWR1

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-20220127305-A1 MELANOCORTIN RECEPTOR LIGANDS IPSEN PHARMA SAS (FR) 2022-04-28 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220127305-A1 MELANOCORTIN RECEPTOR LIGANDS MC3R, MC1R, MC5R C5AR1 72/4885MC4R 4/4885KISS1R 232/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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