SCHEMBL4535188

SCHEMBL4535188

O=c1cc(OCc2ccc(Cl)cn2)ccn1-c1ccc2nc(CCOC3CCCCO3)ccc2c1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 15/20 0.55
KDM4C Q9H3R0 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
P2RX3 P56373 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
SCHEMBL4526497 0.93 MCHR1 (0.57) MCHR1
SCHEMBL4526681 0.88 MCHR1 (0.50) MCHR1KDM4C
SCHEMBL1003466 0.87 MCHR1 (0.52) MCHR1KDM4CNPC1RAB9AP2RX3
SCHEMBL4533300 0.86 MCHR1 (0.54) MCHR1KDM4CL3MBTL1
SCHEMBL1001633 0.84 MCHR1 (0.51) MCHR1KDM4CP2RX3
SCHEMBL4532713 0.84 KDM4C (0.44) MCHR1KDM4CNPC1RAB9AL3MBTL1
SCHEMBL5267094 0.81 MCHR1 (0.56) MCHR1
SCHEMBL4537303 0.81 MCHR1 (0.59) MCHR1
SCHEMBL4534608 0.81 MCHR1 (0.59) MCHR1
SCHEMBL4532738 0.81 MCHR1 (0.59) MCHR1

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 MCHR1 357/4885KDM4C 1474/4885NPC1 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.