SCHEMBL10085685

SCHEMBL10085685

O=C(N[C@H]1C2CC3CC1C[C@](O)(C3)C2)c1csc(NCc2ccccc2)n1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 18/20 0.54
CHEK1 O14757 1/20 0.46
IDH1 O75874 1/20 0.45

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
SCHEMBL525610 1.00 HSD11B1 (0.54) HSD11B1CHEK1IDH1
SCHEMBL10086305 0.90 HSD11B1 (0.52) HSD11B1IDH1
SCHEMBL525274 0.90 HSD11B1 (0.52) HSD11B1IDH1
SCHEMBL525706 0.90 HSD11B1 (0.57) HSD11B1
SCHEMBL10085606 0.90 HSD11B1 (0.57) HSD11B1
SCHEMBL10103199 0.85 HTR3E (0.42) HSD11B1CHEK1IDH1
SCHEMBL10086314 0.85 HSD11B1 (0.46) HSD11B1
SCHEMBL525063 0.85 HSD11B1 (0.46) HSD11B1
SCHEMBL525405 0.83 HSD11B1 (0.55) HSD11B1
SCHEMBL10085246 0.83 HSD11B1 (0.55) HSD11B1

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-8513430-B2 Substituted thiazol-2-ylamine derivatives, pharmaceutical compositions, and methods of use as 11-beta HSD1 modulators HIGH POINT PHARMACEUTICALS, LLC (US) 2013-08-20 US disclosed
US-20120029029-A1 SUBSTITUTED THIAZOL-2-YLAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS 11-BETA HSD1 MODULATORS HIGH POINT PHARMACEUTICALS, LLC (US) 2012-02-02 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-20120029029-A1 SUBSTITUTED THIAZOL-2-YLAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS 11-BETA HSD1 MODULATORS HSD11B1, HSD11B2, HSD3B1 HSD11B1 1/4885CHEK1 4602/4885IDH1 571/4885

“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.