SCHEMBL3225970

SCHEMBL3225970

O=S(=O)(c1ccc(OC(F)(F)F)cc1)N1CCC(c2ccccc2C(F)(F)F)CC1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
LIPE Q05469 1/20 0.53
EPHX2 P34913 3/20 0.52
EPHX1 P07099 2/20 0.50
SCN9A Q15858 1/20 0.48
RBP4 P02753 2/20 0.48
PRCP P42785 1/20 0.48
MAPT P10636 1/20 0.46
GBA1 P04062 1/20 0.45
SFRP1 Q8N474 1/20 0.45
HTR6 P50406 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
SCHEMBL3224467 0.88 HSD11B1 (0.57) MEN1KMT2ARBP4MAPT
SCHEMBL3205508 0.85 KMT2A (0.54) MEN1KMT2AEPHX2RBP4MAPT
SCHEMBL3209386 0.84 HSD11B1 (0.55) MEN1KMT2ARBP4MAPT
SCHEMBL3215762 0.84 GPR183 (0.53) MEN1KMT2ARBP4MAPTSFRP1
SCHEMBL3221289 0.82 HSD11B1 (0.64) MEN1KMT2ARBP4
SCHEMBL3201836 0.82 LMNA (0.60) MEN1KMT2ARBP4MAPT
SCHEMBL3219555 0.80 HSD11B1 (0.64) MEN1KMT2ARBP4MAPTHTR6
SCHEMBL2171815 0.80 EPHX2 (0.61) MEN1KMT2ALIPEEPHX2EPHX1
SCHEMBL3224261 0.79 KMT2A (0.70) MEN1KMT2ARBP4
SCHEMBL3210171 0.78 RBP4 (0.61) KMT2ARBP4

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 MEN1 1354/4885KMT2A 1609/4885LIPE 883/4885
US-20070219198-A1 11-Beta HSD 1 inhibitors HSD11B1, HSD11B2, HSD3B1 MEN1 1687/4885KMT2A 1591/4885LIPE 842/4885

“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.