SCHEMBL1781813

SCHEMBL1781813

CCCNC1CCN(c2ccc(-n3ccc(OCc4ccc(Cl)cn4)cc3=O)cn2)C1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.52
DPP4 P27487 3/20 0.45
KCNH2 Q12809 3/20 0.42
DPP8 Q6V1X1 2/20 0.40
DPP9 Q86TI2 2/20 0.40
GPR119 Q8TDV5 1/20 0.40

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
SCHEMBL1780424 0.94 MCHR1 (0.53) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL1782051 0.94 MCHR1 (0.53) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL1780420 0.94 MCHR1 (0.53) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL1781924 0.92 MCHR1 (0.51) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL1780390 0.90 MCHR1 (0.55) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL1780982 0.90 MCHR1 (0.55) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL1780421 0.90 MCHR1 (0.55) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL1780003 0.87 MCHR1 (0.53) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL1781348 0.87 MCHR1 (0.55) MCHR1DPP4KCNH2DPP8DPP9
SCHEMBL1782599 0.87 MCHR1 (0.51) MCHR1DPP4KCNH2DPP8DPP9

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118261-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXO GROUP LIMITED 2011-05-19 US claimed
US-20110118261-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXO GROUP LIMITED 2011-05-19 US disclosed
US-20110118261-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXO GROUP LIMITED 2011-05-19 US disclosed
US-20110118261-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXO GROUP LIMITED 2011-05-19 US disclosed
EP-2231646-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GlaxoSmithKline LLC (US) 2010-09-29 EP disclosed
WO-2009076387-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXO GROUP LIMITED (GB) 2009-06-18 WO disclosed
WO-2009076387-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS GLAXO GROUP LIMITED (GB) 2009-06-18 WO 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-20110118261-A1 BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS MCHR1, MCHR2, MC1R MCHR1 1/4885DPP4 504/4885KCNH2 3309/4885

“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.