SCHEMBL12848427

SCHEMBL12848427

C=C(C)c1cc(-c2csc(C3(N)CCOCC3)n2)cc(C(C)(C)C)c1OC

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 10/20 0.67
CNR1 P21554 8/20 0.67
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
F2RL3 Q96RI0 2/20 0.31
MTOR P42345 1/20 0.30

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
SCHEMBL2773356 0.89 CNR2 (0.76) CNR2CNR1ALDH1A1GAAMAPK1
SCHEMBL12848686 0.89 CNR2 (0.67) CNR2CNR1ALDH1A1GAAMAPK1
SCHEMBL12848740 0.87 CNR2 (0.80) CNR2CNR1GAAPTGS1PTGS2
SCHEMBL2773050 0.81 CNR2 (1.00) CNR2CNR1GAAPTGS1PTGS2
SCHEMBL2771211 0.77 CNR2 (0.76) CNR2CNR1ALDH1A1GAAMAPK1
SCHEMBL12848739 0.77 CNR2 (0.62) CNR2CNR1GAAPTGS1PTGS2
Hydrochloric Acid SCHEMBL6525331 0.76 CNR2 (0.74) CNR2CNR1ALDH1A1GAAMAPK1
SCHEMBL12848344 0.76 CNR2 (0.80) CNR2CNR1PTGS1PTGS2
SCHEMBL6518485 0.75 CNR2 (0.73) CNR2CNR1ALDH1A1GAAMAPK1
SCHEMBL12848687 0.75 CNR2 (0.46) CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110059970-A1 4-PHENYL-1,3-THIAZOLES AND 4-PHENYL-1,3-OXAZOLES DERIVATIVES AS CANNABINOID RECEPTOR LIGANDS IPSEN PHARMA S.A.S. (FR) 2011-03-10 US 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-20110059970-A1 4-PHENYL-1,3-THIAZOLES AND 4-PHENYL-1,3-OXAZOLES DERIVATIVES AS CANNABINOID RECEPTOR LIGANDS CNR1, CNR2, NPY1R CNR2 2/4885CNR1 1/4885ALDH1A1 1430/4885

“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.