SCHEMBL13636166

SCHEMBL13636166

Cn1c2c(c(=O)n1-c1ccc(Cl)cc1Cl)[C@H]1CC[C@@]23CC13C

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 14/20 0.57
CYP3A4 P08684 3/20 0.41
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
OPRM1 P35372 1/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
ALOX12 P18054 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL13635939 0.91 HSD11B1 (0.69) HSD11B1CYP3A4
SCHEMBL13636065 0.91 HSD11B1 (0.69) HSD11B1CYP3A4
SCHEMBL13636043 0.86 HSD11B1 (0.68) HSD11B1CYP3A4
SCHEMBL13635932 0.85 HSD11B1 (0.53) HSD11B1CYP3A4
SCHEMBL13635936 0.82 HSD11B1 (0.56) HSD11B1CYP3A4
SCHEMBL4369415 0.82 HSD11B1 (0.83) HSD11B1CYP3A4
SCHEMBL13636081 0.81 HSD11B1 (0.55) HSD11B1CYP3A4
SCHEMBL13636270 0.80 HSD11B1 (0.53) HSD11B1CYP3A4
SCHEMBL13636067 0.79 HSD11B1 (0.47) HSD11B1CYP3A4KMT2A
SCHEMBL13636287 0.78 HSD11B1 (0.43) HSD11B1CYP3A4

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-7622492-B2 Pyrazolones as inhibitors of 11β-hydroxysteroid dehydrogenase HOFFMANN-LA ROCHE INC. (US) 2009-11-24 US disclosed
US-20070049632-A1 Pyrazolones as inhibitors of 11B-hydroxysteroid dehydrogenase BANNER BRUCE L 2007-03-01 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-20070049632-A1 Pyrazolones as inhibitors of 11B-hydroxysteroid dehydrogenase HSD17B1, HSD17B2, HSD3B2 HSD11B1 5/4885CYP3A4 124/4885CNR1 4334/4885

“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.