SCHEMBL13724431

SCHEMBL13724431

Bc1ccc(OC)c(CCc2c(Cl)cccc2C(=O)NC(=N)NCCCC)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 10/20 0.46
▸ KCNH2 Q12809 1/20 0.44
▸ HPGD P15428 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ MTNR1A P48039 1/20 0.35
▸ MTNR1B P49286 1/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ LMNA P02545 1/20 0.35

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
SCHEMBL3089933 0.79 MC4R (0.69) MC4R
SCHEMBL13180228 0.78 MC4R (0.48) MC4R
SCHEMBL13147074 0.78 MC4R (0.58) MC4RKCNH2
SCHEMBL13147075 0.77 MC4R (0.59) MC4RKCNH2
SCHEMBL13723344 0.77 MC4R (0.49) MC4R
SCHEMBL13147102 0.76 MC4R (0.51) MC4RKCNH2ALDH1A1LMNA
SCHEMBL13147315 0.73 MC4R (0.54) MC4RKCNH2
SCHEMBL13724355 0.73 MC4R (0.48) MC4R
SCHEMBL13147308 0.73 MC4R (0.49) MC4RKCNH2
SCHEMBL13147155 0.72 MC4R (0.58) 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 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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