SCHEMBL3213328

SCHEMBL3213328

O=S(=O)(c1ccc(Cl)cc1)N1CCN(c2ccc(F)cc2C(F)(F)F)CC1

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 16/20 0.80
▸ LMNA P02545 2/20 0.56
▸ GAA P10253 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ TP53 P04637 1/20 0.56
▸ HTT P42858 1/20 0.56
▸ PKM P14618 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.49

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
SCHEMBL4486893 0.89 HSD11B1 (1.00) HSD11B1LMNAGAASMN1; SMN2TP53
SCHEMBL3226058 0.84 HSD11B1 (0.77) HSD11B1LMNASMN1; SMN2HTT
SCHEMBL4948991 0.83 PKM (0.59) HSD11B1LMNAGAASMN1; SMN2TP53
SCHEMBL3207580 0.82 HSD11B1 (0.72) HSD11B1LMNAGAASMN1; SMN2TP53
SCHEMBL3209913 0.82 HSD11B1 (0.72) HSD11B1LMNAGAASMN1; SMN2HTT
SCHEMBL3210235 0.82 HSD11B1 (0.68) HSD11B1
SCHEMBL13489671 0.80 HSD11B1 (0.69) HSD11B1
SCHEMBL3215928 0.79 HSD11B1 (0.60) HSD11B1LMNAGAASMN1; SMN2HTT
SCHEMBL3222991 0.78 HSD11B1 (0.72) HSD11B1HTT
SCHEMBL3223548 0.78 HSD11B1 (0.72) HSD11B1HTT

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 3 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
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 1/4885LMNA 3748/4885GAA 2353/4885
US-20070219198-A1 11-Beta HSD 1 inhibitors HSD11B1, HSD11B2, HSD3B1 HSD11B1 1/4885LMNA 3681/4885GAA 2688/4885

“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.

Send feedback