SCHEMBL5766154

SCHEMBL5766154

COc1ccc(Br)cc1CCc1c(Cl)cccc1C1(CC=O)NCCN1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.53
▸ MC4R P32245 14/20 0.49
▸ LMNA P02545 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ PKM P14618 1/20 0.38

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
SCHEMBL5763829 0.87 KCNH2 (0.50) KCNH2MC4RLMNAHPGDPKM
SCHEMBL5767273 0.86 MC4R (0.53) KCNH2MC4RLMNAHPGDPKM
SCHEMBL7206481 0.85 KCNH2 (0.53) KCNH2MC4RPKM
SCHEMBL7206492 0.84 KCNH2 (0.58) KCNH2MC4RLMNAHPGD
SCHEMBL5766784 0.83 KCNH2 (0.52) KCNH2MC4RLMNAHPGD
SCHEMBL5768686 0.81 KCNH2 (0.50) KCNH2MC4RLMNAHPGD
SCHEMBL4067065 0.78 KCNH2 (0.56) KCNH2MC4RLMNAHPGD
SCHEMBL5767776 0.77 KCNH2 (0.52) KCNH2MC4RLMNAHPGD
SCHEMBL5767311 0.76 KCNH2 (0.50) KCNH2MC4RLMNAHPGD
SCHEMBL5766403 0.76 KCNH2 (0.50) KCNH2MC4RLMNAHPGD

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-1644337-A1 MELANOCORTIN-4 RECEPTOR BINDING COMPOUNDS AND METHODS OF USE THEREOF Gene Logic, Inc. (US) 2006-04-12 — — EP disclosed
WO-2005121100-A1 MELANOCORTIN-4 RECEPTOR BINDING COMPOUNDS AND METHODS OF USE THEREOF GENE LOGIC INC. (US) 2005-12-22 — — WO disclosed
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