SCHEMBL13766740

SCHEMBL13766740

CS(=O)(=O)OCCn1ncc(C(=O)NC23CC4CC(CC(C4)C2)C3)c1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.54
FAAH O00519 7/20 0.54
CNR1 P21554 4/20 0.54
CASR P41180 5/20 0.43
EPHX2 P34913 2/20 0.42
MAPT P10636 2/20 0.40
HTT P42858 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
ALOX12 P18054 1/20 0.40
ATM Q13315 1/20 0.40
HSD17B10 Q99714 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
SCHEMBL13766732 0.86 EPHX2 (0.42) CNR2CNR1EPHX2HTT
SCHEMBL13766918 0.84 CNR2 (0.63) CNR2FAAHCNR1CASREPHX2
SCHEMBL13766775 0.82 POLB (0.44) CNR2FAAHCNR1CASREPHX2
SCHEMBL17226648 0.79 CNR2 (0.31) CNR2FAAHCNR1CASRALDH1A1
SCHEMBL2017354 0.77 CNR2 (0.53) CNR2FAAHCNR1CASREPHX2
SCHEMBL14098469 0.76 MERTK (0.37) CNR2CNR1ALDH1A1
SCHEMBL17226610 0.75 MEN1 (0.38) CNR2CNR1ALDH1A1
SCHEMBL8111487 0.75 CNR2 (0.55) CNR2FAAHCNR1CASRMAPT
SCHEMBL14098589 0.74 CNR2 (0.50) CNR2FAAHCNR1CASREPHX2
SCHEMBL8122848 0.74 CNR2 (0.52) CNR2FAAHCNR1EPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1953145-B1 HETEROCYCLIC COMPOUND HAVING INHIBITORY ACTIVITY ON 11-B-HYDROXYSTEROID DEHYDROGENASE TYPE I SHIONOGI & CO (JP) 2015-11-04 EP disclosed
US-8324265-B2 Heterocyclic compounds having type I 11β hydroxysteroid dehydrogenase inhibitory activity SHIONOGI & CO., LTD. (JP) 2012-12-04 US disclosed
US-20090170832-A1 HETEROCYCLIC COMPOUNDS HAVING TYPE I 11beta HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY SHIONOGI & CO., LTD. (JP) 2009-07-02 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-20090170832-A1 HETEROCYCLIC COMPOUNDS HAVING TYPE I 11beta HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY HSD17B1, HSD11B1, HSD3B1 CNR2 1522/4885FAAH 1693/4885CNR1 684/4885

“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.