SCHEMBL4634322

SCHEMBL4634322

CCOC(=O)c1nn(-c2ccccc2Cl)c(-c2ccc(-c3nnn(C)n3)cc2)c1C

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.47
CNR1 P21554 2/20 0.47
ALDH1A1 P00352 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
PDE4A P27815 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
CYP19A1 P11511 3/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
CNR2 P34972 1/20 0.43

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
SCHEMBL700719 0.86 CNR1 (0.58) PDE4BCNR1CYP19A1CNR2
SCHEMBL4910813 0.85 PDE4B (0.54) PDE4BCNR1ALDH1A1NPSR1PDE4A
SCHEMBL4634312 0.84 CNR1 (0.53) PDE4BCNR1ALDH1A1NPSR1PDE4A
SCHEMBL4633677 0.83 PDE4B (0.52) PDE4BCNR1ALDH1A1NPSR1PDE4A
SCHEMBL4632911 0.81 MAPT (0.53) PDE4BCNR1ALDH1A1NPSR1PDE4A
SCHEMBL4632339 0.80 CA9 (0.56) PDE4BCNR1ALDH1A1NPSR1PDE4A
SCHEMBL4884407 0.79 CNR1 (0.58) CNR1CNR2
SCHEMBL4611618 0.79 PDE4B (0.47) PDE4BCNR1ALDH1A1NPSR1PDE4A
SCHEMBL4888316 0.78 CNR1 (0.49) CNR1CNR2
SCHEMBL4910447 0.78 PDE4B (0.47) PDE4BCNR1ALDH1A1NPSR1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200527-A1 Cannabinoid Receptor Modulators CAREX SA (FR) 2008-08-21 US disclosed
US-20080200527-A1 Cannabinoid Receptor Modulators CAREX SA (FR) 2008-08-21 US disclosed
US-20080200527-A1 Cannabinoid Receptor Modulators CAREX SA (FR) 2008-08-21 US disclosed
EP-1928859-A1 PYRAZOLE DERIVATES AS CANNABINOID RECEPTOR MODULATORS Carex SA (FR) 2008-06-11 EP disclosed
WO-2006133926-A1 PYRAZOLE DERIVATES AS CANNABINOID RECEPTOR MODULATORS CAREX SA (FR) 2006-12-21 WO 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-20080200527-A1 Cannabinoid Receptor Modulators CNR1, CNR2, HCRTR2 PDE4B 3327/4885CNR1 1/4885ALDH1A1 2431/4885

“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.