SCHEMBL2881635

SCHEMBL2881635

O=c1cc(OCc2ccc(F)cc2)ccn1OCc1ccc(CNC2CC2)cc1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 17/20 0.67
KCNH2 Q12809 2/20 0.47
HRH3 Q9Y5N1 1/20 0.44
MAOB P27338 1/20 0.42
GRM5 P41594 1/20 0.42
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL2882003 0.89 MCHR1 (0.62) MCHR1KCNH2HRH3
SCHEMBL2881877 0.85 MCHR1 (0.59) MCHR1KCNH2HRH3MAOBGRM5
SCHEMBL2883944 0.81 MCHR1 (0.53) MCHR1KCNH2
SCHEMBL2881882 0.81 MCHR1 (0.50) MCHR1KCNH2HRH3
SCHEMBL2879976 0.80 MCHR1 (1.00) MCHR1KCNH2
SCHEMBL2883572 0.80 MCHR1 (0.67) MCHR1KCNH2HRH3MAOB
SCHEMBL2883510 0.80 MCHR1 (0.49) MCHR1KCNH2HRH3
SCHEMBL2881864 0.78 MCHR1 (0.64) MCHR1KCNH2HRH3MAOB
SCHEMBL2882082 0.78 MCHR1 (0.59) MCHR1KCNH2HRH3
SCHEMBL2876573 0.78 MCHR1 (0.70) MCHR1KCNH2

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 2487/4885HRH3 208/4885

“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.