SCHEMBL30457637

SCHEMBL30457637

COc1cc(C(C)C(=O)N2CC[C@H](Nc3ccc(-c4ncccn4)c(C)n3)C2)c(Cl)cn1

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 19/20 0.83
▸ KCNH2 Q12809 5/20 0.65
▸ MC5R P33032 1/20 0.43
▸ MC3R P41968 1/20 0.43
▸ CCNK O75909 1/20 0.39
▸ CDK12 Q9NYV4 1/20 0.39

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
SCHEMBL25276740 1.00 MC4R (0.83) MC4RKCNH2MC5RMC3RCCNK
SCHEMBL25227171 1.00 MC4R (0.83) MC4RKCNH2MC5RMC3RCCNK
SCHEMBL30457504 1.00 MC4R (0.83) MC4RKCNH2MC5RMC3RCCNK
SCHEMBL31687307 0.91 MC4R (1.00) MC4RKCNH2MC5RMC3R
SCHEMBL31687274 0.91 MC4R (0.83) MC4RKCNH2MC5RMC3R
SCHEMBL31687280 0.90 MC4R (0.68) MC4RKCNH2
Formic Acid SCHEMBL31666912 0.89 MC4R (0.81) MC4RKCNH2MC5RMC3RCCNK
SCHEMBL30996498 0.89 MC4R (0.67) MC4RKCNH2CCNKCDK12
SCHEMBL31666908 0.88 MC4R (0.66) MC4RKCNH2
SCHEMBL30996497 0.87 MC4R (0.86) MC4RKCNH2

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
EP-4444708-A1 MELANOCORTIN 4 RECEPTOR ANTAGONISTS AND USES THEREOF Pfizer Inc. (US) 2024-10-16 — — EP disclosed
WO-2023105387-A1 MELANOCORTIN 4 RECEPTOR ANTAGONISTS AND USES THEREOF PFIZER INC. (US) 2023-06-15 — — WO disclosed
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