SCHEMBL525706

SCHEMBL525706

O=C(NC1C2CC3CC1CC(O)(C3)C2)c1csc(NCc2cccnc2)n1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 17/20 0.57
CYP17A1 P05093 1/20 0.43
CYP19A1 P11511 1/20 0.43
P2RX7 Q99572 1/20 0.42

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
SCHEMBL10085606 1.00 HSD11B1 (0.57) HSD11B1CYP17A1CYP19A1P2RX7
SCHEMBL10085246 0.91 HSD11B1 (0.55) HSD11B1
SCHEMBL525405 0.91 HSD11B1 (0.55) HSD11B1
SCHEMBL525610 0.90 HSD11B1 (0.54) HSD11B1
SCHEMBL10085685 0.90 HSD11B1 (0.54) HSD11B1
SCHEMBL10103350 0.87 HSD11B1 (0.43) HSD11B1CYP17A1CYP19A1P2RX7
SCHEMBL525184 0.84 HSD11B1 (0.51) HSD11B1
SCHEMBL10085603 0.84 HSD11B1 (0.51) HSD11B1
SCHEMBL10086305 0.83 HSD11B1 (0.52) HSD11B1
SCHEMBL525274 0.83 HSD11B1 (0.52) 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-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 claimed
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 1/4885CYP17A1 24/4885CYP19A1 93/4885

“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.