SCHEMBL19334932

SCHEMBL19334932

CC[C@H](C)[C@@H]1NC(=O)N([C@@H](CS)C(=O)N[C@H](C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@H](Cc2ccccc2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NC(Cc2c[nH]c3ccccc23)C(=O)N[C@@H](CSC)C(N)=O)C1=O

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 6/20 0.54
▸ GHSR Q92847 10/20 0.50
▸ GRPR P30550 2/20 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
SCHEMBL20108402 0.96 MC4R (0.56) MC4RGHSRGRPR
SCHEMBL20108332 0.89 MC4R (0.57) MC4RGHSR
SCHEMBL20108370 0.89 MC4R (0.57) MC4RGHSR
SCHEMBL19334897 0.89 MC4R (0.52) MC4RGHSRGRPR
SCHEMBL19334877 0.89 MC4R (0.55) MC4RGHSRGRPR
SCHEMBL19334872 0.89 MC4R (0.53) MC4RGHSRGRPR
SCHEMBL20108360 0.89 MC4R (0.53) MC4RGHSRGRPR
SCHEMBL20108238 0.88 MC4R (0.56) MC4RGHSRGRPR
SCHEMBL23430195 0.88 MC4R (0.55) MC4RGHSRGRPR
SCHEMBL20108329 0.87 MC4R (0.57) MC4RGHSRGRPR

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-9758549-B2 Melanocortin receptor ligands modified with hydantoin IPSEN PHARMA S.A.S. (FR) 2017-09-12 — — US disclosed
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