SCHEMBL11891319

SCHEMBL11891319

CCCCN(CCCC)C(=O)c1ccc2nc(-c3ccc([N+](=O)[O-])cc3)n(CCCN3CCCCC3)c2c1

nearest known ligand 0.66

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 20/20 0.66
▸ MC5R P33032 3/20 0.50
▸ MC3R P41968 3/20 0.50
▸ MC1R Q01726 2/20 0.49

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
SCHEMBL11891336 0.91 MC4R (0.59) MC4RMC5RMC3RMC1R
SCHEMBL11891230 0.91 MC4R (0.81) MC4RMC5RMC3RMC1R
SCHEMBL11891318 0.90 MC4R (0.79) MC4RMC5RMC3RMC1R
SCHEMBL11891169 0.89 MC4R (0.81) MC4RMC5RMC3RMC1R
SCHEMBL11891214 0.88 MC4R (0.70) MC4RMC5RMC3RMC1R
SCHEMBL11891220 0.88 MC4R (0.70) MC4RMC5RMC3RMC1R
SCHEMBL11891213 0.88 MC4R (0.70) MC4RMC5RMC3RMC1R
SCHEMBL11891387 0.88 MC4R (0.69) MC4RMC5RMC3RMC1R
SCHEMBL11891171 0.87 MC4R (0.82) MC4RMC5RMC3RMC1R
SCHEMBL14226126 0.87 MC4R (0.68) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8227485-B2 Benzimidazole and imidazopyridine derivatives and use thereof as a medicament IPSEN PHARMA S.A.S. (FR) 2012-07-24 — — US disclosed
US-8227485-B2 Benzimidazole and imidazopyridine derivatives and use thereof as a medicament IPSEN PHARMA S.A.S. (FR) 2012-07-24 — — US disclosed
EP-1692114-B1 NOVEL BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AND USE THEREOF AS A MEDICAMENT IPSEN PHARMA (FR) 2010-09-22 — — EP disclosed
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