SCHEMBL3212450

SCHEMBL3212450

O=S(=O)(c1ccccc1)C1CCN(c2ncccc2C(F)(F)F)CC1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 19/20 0.67
EPHX2 P34913 1/20 0.53

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
SCHEMBL3220012 0.90 HSD11B1 (0.69) HSD11B1EPHX2
SCHEMBL3219566 0.88 HSD11B1 (0.70) HSD11B1
SCHEMBL3221195 0.87 HSD11B1 (0.70) HSD11B1EPHX2
SCHEMBL3223500 0.87 HSD11B1 (0.70) HSD11B1EPHX2
SCHEMBL3209176 0.84 HSD11B1 (0.72) HSD11B1
SCHEMBL3222429 0.84 HSD11B1 (0.56) HSD11B1EPHX2
SCHEMBL3221653 0.81 HSD11B1 (0.53) HSD11B1EPHX2
SCHEMBL3210183 0.80 HSD11B1 (1.00) HSD11B1
SCHEMBL30582915 0.79 EPHX2 (0.68) HSD11B1EPHX2
SCHEMBL1252470 0.77 TRPV1 (0.66) HSD11B1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100029648-A1 11-Beta HSD1 Inhibitors XIANG JASON SHAOYUN 2010-02-04 US disclosed
US-7632838-B2 11-beta HSD1 inhibitors WYETH (US) 2009-12-15 US disclosed
CN-101400653-A 11-beta HSD1 inhibitors WYETH CORP (US) 2009-04-01 CN disclosed
US-20070219198-A1 11-Beta HSD 1 inhibitors WYETH (US) 2007-09-20 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 (2 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-20100029648-A1 11-Beta HSD1 Inhibitors HSD11B1, HSD3B1, HSD11B2 HSD11B1 1/4885EPHX2 867/4885
US-20070219198-A1 11-Beta HSD 1 inhibitors HSD11B1, HSD11B2, HSD3B1 HSD11B1 1/4885EPHX2 713/4885

“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.