SCHEMBL30355183

SCHEMBL30355183

COc1cc(C(C)C(=O)N2CCC3(CCc4cc(-c5nnn(C)n5)c(C)nc4N3)C2)nc(C)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 19/20 1.00
▸ MC5R P33032 1/20 0.46
▸ MC3R P41968 1/20 0.46
▸ KCNH2 Q12809 1/20 0.46

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
SCHEMBL25421472 1.00 MC4R (1.00) MC4RMC5RMC3RKCNH2
SCHEMBL31139111 1.00 MC4R (1.00) MC4RMC5RMC3RKCNH2
SCHEMBL30184827 1.00 MC4R (1.00) MC4RMC5RMC3RKCNH2
SCHEMBL24940753 1.00 MC4R (1.00) MC4RMC5RMC3RKCNH2
SCHEMBL24939959 1.00 MC4R (1.00) MC4RMC5RMC3RKCNH2
SCHEMBL24939963 1.00 MC4R (1.00) MC4RMC5RMC3RKCNH2
SCHEMBL24940672 1.00 MC4R (1.00) MC4RMC5RMC3RKCNH2
SCHEMBL25586304 0.96 MC4R (0.92) MC4RMC5RMC3RKCNH2
SCHEMBL24940872 0.96 MC4R (0.92) MC4RMC5RMC3RKCNH2
SCHEMBL24940690 0.92 MC4R (0.85) MC4RMC5RMC3RKCNH2

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
EP-4161927-A1 SPIRO COMPOUNDS AS MELANOCORTIN 4 RECEPTOR ANTAGONISTS AND USES THEREOF Pfizer Inc. (US) 2023-04-12 — — EP disclosed
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