SCHEMBL4532713

SCHEMBL4532713

O=c1cc(O)ccn1-c1ccc2nc(CCOC3CCCCO3)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
P2RX3 P56373 3/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MIF P14174 1/20 0.35
MCHR1 Q99705 6/20 0.34
MET P08581 2/20 0.33

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
SCHEMBL4526681 0.85 MCHR1 (0.50) KDM4CMCHR1
SCHEMBL4535188 0.84 MCHR1 (0.55) KDM4CL3MBTL1NPC1RAB9AP2RX3
SCHEMBL4533300 0.84 MCHR1 (0.54) KDM4CL3MBTL1MCHR1
SCHEMBL1003055 0.81 P2RX3 (0.42) KDM4CL3MBTL1NPC1RAB9AP2RX3
SCHEMBL1002650 0.78 MEN1 (0.45) KDM4CL3MBTL1NPC1RAB9AP2RX3
SCHEMBL4540800 0.77 MCHR1 (0.52) MCHR1
SCHEMBL4526497 0.75 MCHR1 (0.57) MCHR1
SCHEMBL2887433 0.72 MEN1 (0.38) MEN1KMT2AMCHR1
SCHEMBL1003466 0.69 MCHR1 (0.52) KDM4CNPC1RAB9AP2RX3MCHR1
SCHEMBL4537433 0.66 CYP1A2 (0.44) NPC1RAB9AMEN1KMT2AMCHR1

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-20090264426-A1 Bicyclic aromatic substituted pyridone derivative MSD K.K. (JP) 2009-10-22 US disclosed
EP-1939194-A1 BICYCLIC AROMATIC SUBSTITUTED PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-07-02 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-20090264426-A1 Bicyclic aromatic substituted pyridone derivative PYCR1, CHRM1, MTR KDM4C 1474/4885L3MBTL1 188/4885NPC1 3130/4885

“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.