SCHEMBL14394904

SCHEMBL14394904

CCCCCN(C)CCCn1c(Nc2cccs2)nc2ccc(C(=O)N(CCCC)CCCC)cc21

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 19/20 0.55
▸ ITK Q08881 1/20 0.44
▸ MC5R P33032 1/20 0.43
▸ MC3R P41968 1/20 0.43
▸ MC1R Q01726 1/20 0.43

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
SCHEMBL13124680 0.87 MC4R (0.62) MC4RMC5RMC3RMC1R
SCHEMBL13124632 0.86 MC4R (0.63) MC4RMC5RMC3RMC1R
SCHEMBL13124630 0.77 MC4R (0.78) MC4RMC5RMC3RMC1R
SCHEMBL13124769 0.74 MC4R (0.64) MC4RMC5RMC3RMC1R
SCHEMBL13123858 0.74 MC4R (0.79) MC4RMC5RMC3RMC1R
SCHEMBL13124455 0.74 MC4R (0.65) MC4RMC5RMC3RMC1R
SCHEMBL13123856 0.73 MC4R (0.78) MC4RMC5RMC3RMC1R
SCHEMBL13124994 0.72 MC4R (0.82) MC4RMC5RMC3RMC1R
SCHEMBL13124684 0.72 MC4R (0.81) MC4RMC5RMC3RMC1R
SCHEMBL13124676 0.72 MC4R (0.70) MC4RMC5RMC3RMC1R

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-1599167-B1 BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES HAVING AFFINITY FOR THE MELANOCORTIN RECEPTORS AND USE THEREOF AS A MEDICAMENT SOD CONSEILS RECH APPLIC (FR) 2007-10-03 — — EP disclosed
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