SCHEMBL3225812

SCHEMBL3225812

O=C1CN(S(=O)(=O)c2ccc(Cl)c(Cl)c2)CCN1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.66
GFER P55789 1/20 0.57
GLA P06280 1/20 0.52
RAB9A P51151 2/20 0.52
KDM4E B2RXH2 1/20 0.51
POLB P06746 1/20 0.51
MAPK1 P28482 1/20 0.49
MAPT P10636 1/20 0.49
HSD11B1 P28845 2/20 0.47
TDO2 P48775 1/20 0.47
CTSG P08311 2/20 0.47
CMA1 P23946 2/20 0.47
USP2 O75604 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
CYP3A4 P08684 1/20 0.45
GAA P10253 1/20 0.45
CYP2C19 P33261 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
SCHEMBL13489662 0.83 MAPT (0.70) PKMRAB9AKDM4EPOLBMAPK1
Hydrochloric Acid SCHEMBL4274 0.81 MAPT (0.68) PKMRAB9AKDM4EPOLBMAPK1
SCHEMBL3217362 0.78 PKM (0.69) PKMGFERHSD11B1
SCHEMBL494192 0.77 KDM4E (0.74) RAB9AKDM4EPOLBMAPK1USP2
SCHEMBL17396 0.77 POLB (0.61) PKMGFERGLARAB9APOLB
SCHEMBL29657474 0.77 POLB (0.61) PKMGFERGLARAB9APOLB
SCHEMBL29764438 0.77 GFER (0.65) PKMGFERGLARAB9AKDM4E
SCHEMBL3928664 0.77 GFER (0.69) PKMGFERGLAPOLBMAPT
SCHEMBL3915047 0.77 GLA (0.78) PKMGFERGLARAB9AMAPT
SCHEMBL15372156 0.77 GFER (0.64) PKMGFERGLARAB9APOLB

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 5 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
EP-1981848-A2 11-BETA HSD1 INHIBITORS Wyeth (US) 2008-10-22 EP disclosed
US-20070219198-A1 11-Beta HSD 1 inhibitors WYETH (US) 2007-09-20 US disclosed
WO-2007092435-A2 11-BETA HSD1 INHIBITORS WYETH (US) 2007-08-16 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 (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 PKM 2924/4885GFER 3442/4885GLA 2690/4885
US-20070219198-A1 11-Beta HSD 1 inhibitors HSD11B1, HSD11B2, HSD3B1 PKM 2798/4885GFER 2940/4885GLA 2816/4885

“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.