SCHEMBL11891168

SCHEMBL11891168

COc1cccc(Cc2nc3ccc(CN(CCC(C)C)CCC(C)C)cc3n2CCCN2CCCCC2)c1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 15/20 0.63
▸ MC5R P33032 3/20 0.55
▸ MC3R P41968 3/20 0.55
▸ MC1R Q01726 2/20 0.49
▸ USP2 O75604 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ F2R P25116 2/20 0.42
▸ LTA4H P09960 1/20 0.42

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
SCHEMBL11891170 0.92 MC4R (0.73) MC4RMC5RMC3RMC1R
SCHEMBL11891182 0.90 MC4R (0.52) MC4RMC5RMC3RMC1RUSP2
SCHEMBL11891158 0.86 MC4R (0.59) MC4RMC5RMC3RMC1R
SCHEMBL11891128 0.85 MC4R (0.84) MC4RMC5RMC3RMC1R
SCHEMBL13124419 0.84 MC4R (0.60) MC4RMC5RMC3RMC1R
SCHEMBL11891166 0.83 MC4R (0.55) MC4RMC5RMC3RMC1R
SCHEMBL11891159 0.82 MC4R (0.70) MC4RMC5RMC3RMC1R
SCHEMBL11891183 0.82 MC4R (0.61) MC4RMC5RMC3RMC1R
SCHEMBL11891137 0.81 MC4R (0.74) MC4RMC5RMC3RMC1R
SCHEMBL13124407 0.80 MC4R (0.72) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120316201-A1 NOVEL BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AND USE THEREOF AS A MEDICAMENT IPSEN PHARMA S.A.S. (FR) 2012-12-13 — — US disclosed
US-20120316201-A1 NOVEL BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AND USE THEREOF AS A MEDICAMENT IPSEN PHARMA S.A.S. (FR) 2012-12-13 — — 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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120316201-A1 NOVEL BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AND USE THEREOF AS A MEDICAMENT MC4R, MC5R, MC1R MC4R 1/4885MC5R 2/4885MC3R 4/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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