SCHEMBL13725268

SCHEMBL13725268

CCN(CC)CCCC(C)N/C(=N\C(=O)c1cccc(F)c1CCc1cc(C)ccc1OC)Nc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 14/20 0.62
▸ BCHE P06276 5/20 0.37
▸ ACHE P22303 5/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37

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
SCHEMBL13146946 0.92 MC4R (0.73) MC4R
SCHEMBL13724664 0.83 MC4R (0.64) MC4R
SCHEMBL13146941 0.83 MC4R (0.77) MC4R
SCHEMBL13146927 0.83 MC4R (0.77) MC4R
SCHEMBL3080662 0.77 MC4R (0.84) MC4R
SCHEMBL3080663 0.77 MC4R (0.84) MC4R
SCHEMBL3822981 0.77 MC4R (1.00) MC4R
SCHEMBL3077963 0.76 MC4R (0.88) MC4R
SCHEMBL3077948 0.76 MC4R (0.88) MC4R
SCHEMBL13146977 0.75 MC4R (0.65) MC4RKDM4EALDH1A1

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-1590338-B1 MODULATORS OF MELANOCORTIN RECEPTOR ORE PHARMACEUTICALS INC (US) 2009-08-26 — — EP disclosed
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