SCHEMBL1902500

SCHEMBL1902500

C[C@@H](c1ccc(-c2ccn(C)c(=O)c2)cc1)N1C[C@](CC(C)(C)O)(c2ccccc2)OC1=O

nearest known ligand 0.84

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 19/20 0.84
CYP2C9 P11712 10/20 0.84
CYP2C19 P33261 9/20 0.71
CYP3A4 P08684 7/20 0.69

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
SCHEMBL1029194 1.00 HSD11B1 (0.84) HSD11B1CYP2C9CYP2C19CYP3A4
SCHEMBL1029191 1.00 HSD11B1 (0.84) HSD11B1CYP2C9CYP2C19CYP3A4
SCHEMBL117891 0.91 HSD11B1 (1.00) HSD11B1CYP2C9CYP2C19CYP3A4
SCHEMBL26688568 0.91 HSD11B1 (1.00) HSD11B1CYP2C9CYP2C19CYP3A4
SCHEMBL117892 0.91 HSD11B1 (1.00) HSD11B1CYP2C9CYP2C19CYP3A4
SCHEMBL23798791 0.91 HSD11B1 (1.00) HSD11B1CYP2C9CYP2C19CYP3A4
SCHEMBL1906511 0.91 HSD11B1 (0.73) HSD11B1CYP2C9CYP2C19CYP3A4
SCHEMBL23798790 0.91 HSD11B1 (1.00) HSD11B1CYP2C9CYP2C19CYP3A4
SCHEMBL12670499 0.91 HSD11B1 (0.73) HSD11B1CYP2C9CYP2C19CYP3A4
Water SCHEMBL15153126 0.91 HSD11B1 (0.98) HSD11B1CYP2C9CYP2C19CYP3A4

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
EP-2274287-B1 INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 VITAE PHARMACEUTICALS INC (US) 2016-03-09 EP disclosed
EP-2274287-B1 INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 VITAE PHARMACEUTICALS INC (US) 2016-03-09 EP disclosed
US-20110105504-A1 Inhibitors Of 11beta-Hydroxysteroid Dehydrogenase Type 1 Vitae Pharmaceuticals ,Inc. 2011-05-05 US disclosed
US-20110105504-A1 Inhibitors Of 11beta-Hydroxysteroid Dehydrogenase Type 1 Vitae Pharmaceuticals ,Inc. 2011-05-05 US disclosed
US-20110105504-A1 Inhibitors Of 11beta-Hydroxysteroid Dehydrogenase Type 1 Vitae Pharmaceuticals ,Inc. 2011-05-05 US disclosed
WO-2009117109-A1 INHIBITORS OF 11BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 VITAE PHARMACEUTICALS, INC. (US) 2009-09-24 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-20110105504-A1 Inhibitors Of 11beta-Hydroxysteroid Dehydrogenase Type 1 HSD11B1, HSD17B1, HSD11B2 HSD11B1 1/4885CYP2C9 184/4885CYP2C19 115/4885

“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.