SCHEMBL4612450

SCHEMBL4612450

CCOC(=O)c1nn(-c2ccc(Cl)cc2Cl)c(-c2ccc(O)cc2)c1C

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.67
PPARA Q07869 1/20 0.67
CNR2 P34972 10/20 0.65
KDM4E B2RXH2 1/20 0.60
MEN1 O00255 1/20 0.60
MAPT P10636 1/20 0.60
MAPK1 P28482 1/20 0.60
KMT2A Q03164 1/20 0.60

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
SCHEMBL29838956 0.95 CNR2 (0.71) CNR1CNR2
SCHEMBL923180 0.95 CNR2 (0.71) CNR1CNR2
SCHEMBL12907707 0.93 CNR1 (0.66) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL662250 0.92 CNR1 (0.65) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL2873082 0.91 CNR1 (0.65) CNR1CNR2KDM4EMEN1MAPT
SCHEMBL30961554 0.91 CNR1 (0.68) CNR1CNR2
SCHEMBL2627954 0.91 CNR1 (0.68) CNR1CNR2
SCHEMBL4612325 0.90 CNR1 (0.62) CNR1PPARACNR2
SCHEMBL2875643 0.90 CNR1 (0.63) CNR1PPARACNR2KDM4EMEN1
SCHEMBL4612523 0.89 CNR1 (0.57) CNR1PPARACNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080287517-A1 Pyrazole Derivatives as Cb1 Modulators ASTRAZENECA AB (SE) 2008-11-20 US disclosed
US-20080146614-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-06-19 US disclosed
EP-1910331-A1 PYRAZOLE DERIVATIVES AS CBl MODULATORS AstraZeneca AB (SE) 2008-04-16 EP disclosed
EP-1831177-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2007-09-12 EP disclosed
WO-2007010217-A1 PYRAZOLE DERIVATIVES AS CBl MODULATORS ASTRAZENECA AB (SE) 2007-01-25 WO disclosed
WO-2006067443-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2006-06-29 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 (2 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-20080287517-A1 Pyrazole Derivatives as Cb1 Modulators CNR1, CNR2, HTR3C CNR1 1/4885PPARA 827/4885CNR2 2/4885
US-20080146614-A1 Therapeutic Agents BDNF, NLN, GRIN2C CNR1 597/4885PPARA 509/4885CNR2 480/4885

“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.