SCHEMBL2885587

SCHEMBL2885587

O=c1cc(OCc2ccc(F)cc2)ccn1CCc1ccc(CCO)cc1

nearest known ligand 0.71

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 19/20 0.71
KCNH2 Q12809 3/20 0.68
MAPK14 Q16539 1/20 0.49
HRH3 Q9Y5N1 1/20 0.47

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
SCHEMBL1364836 0.93 MCHR1 (0.71) MCHR1KCNH2MAPK14HRH3
SCHEMBL2881853 0.91 MCHR1 (0.72) MCHR1KCNH2MAPK14HRH3
SCHEMBL1364692 0.88 MCHR1 (0.74) MCHR1KCNH2MAPK14HRH3
SCHEMBL27751494 0.88 MCHR1 (0.74) MCHR1KCNH2MAPK14HRH3
SCHEMBL2881382 0.88 MCHR1 (0.71) MCHR1KCNH2MAPK14HRH3
SCHEMBL2879716 0.85 MCHR1 (0.61) MCHR1KCNH2MAPK14HRH3
SCHEMBL2876830 0.85 MCHR1 (0.67) MCHR1KCNH2MAPK14
SCHEMBL2876331 0.85 MCHR1 (0.74) MCHR1KCNH2MAPK14
SCHEMBL2881935 0.85 MCHR1 (0.77) MCHR1KCNH2MAPK14
SCHEMBL2878275 0.85 MCHR1 (0.88) MCHR1KCNH2HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100216758-A1 Pyridone Compounds MSD K.K. (JP) 2010-08-26 US disclosed
EP-1916239-A1 PYRIDONE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-04-30 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-20100216758-A1 Pyridone Compounds NPY1R, MC5R, MC1R MCHR1 4/4885KCNH2 2487/4885MAPK14 2278/4885

“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.