SCHEMBL2895667

SCHEMBL2895667

O=c1cc(OCc2ccc(F)cc2)cnn1-c1ccc(OC2CCCCO2)cc1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.42
MAOB P27338 2/20 0.41
GRM5 P41594 1/20 0.41
KCNH2 Q12809 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
GPR84 Q9NQS5 1/20 0.38
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.36
DHFR P00374 1/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
PKM P14618 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL2895097 0.84 MCHR1 (0.59) MCHR1KCNH2HRH3
SCHEMBL2893798 0.83 MAPK14 (0.51) MCHR1NPC1RAB9AL3MBTL1POLB
SCHEMBL1366940 0.78 CYP4F2 (0.46) MCHR1MAOBGRM5KCNH2HRH3
SCHEMBL2891173 0.75 MCHR1 (0.71) MCHR1KCNH2HRH3
SCHEMBL2892007 0.74 MCHR1 (0.62) MCHR1KCNH2
SCHEMBL2891194 0.73 MCHR1 (0.55) MCHR1KCNH2HRH3
SCHEMBL1002625 0.72 MCHR1 (0.56) MCHR1KCNH2HRH3
SCHEMBL7776352 0.72 TRPA1 (0.44) NPC1RAB9AL3MBTL1POLBDHFR
SCHEMBL7236815 0.72 TRPA1 (0.44) NPC1RAB9AL3MBTL1POLBDHFR
SCHEMBL1002918 0.71 MCHR1 (0.55) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7732456-B2 Pyridone derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-08 US disclosed
US-20070208046-A1 Pyridone derivative MSD K.K. (JP) 2007-09-06 US disclosed
EP-1741703-A1 PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-01-10 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-20070208046-A1 Pyridone derivative CHRM1, XDH, MTR MCHR1 535/4885MAOB 203/4885GRM5 431/4885

“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.