SCHEMBL3224151

SCHEMBL3224151

O=S(=O)(c1cccc(Cl)c1)C1CCN(c2nccc3ccccc23)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.46
HTR2C P28335 1/20 0.46
MALT1 Q9UDY8 1/20 0.44
HTR6 P50406 6/20 0.43
HTR1A P08908 5/20 0.43
DRD2 P14416 5/20 0.43
HTR7 P34969 5/20 0.43
GBA1 P04062 1/20 0.43
KIT P10721 1/20 0.42
HSD11B1 P28845 1/20 0.42
KIF18A Q8NI77 3/20 0.41
HTR2A P28223 1/20 0.41
PDE10A Q9Y233 1/20 0.41
GRM5 P41594 1/20 0.40
CTSS P25774 1/20 0.40

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
SCHEMBL3218488 0.88 HRH4 (0.49) HRH4HTR2CMALT1HTR6HTR1A
SCHEMBL3201988 0.87 MALT1 (0.46) HRH4HTR2CMALT1HTR6GBA1
SCHEMBL3219594 0.85 HRH4 (0.49) HRH4HTR2CMALT1HTR6GBA1
SCHEMBL3214389 0.82 MALT1 (0.56) MALT1HSD11B1KIF18A
SCHEMBL3219593 0.80 HSD11B1 (0.51) MALT1HTR6HTR1ADRD2HTR7
SCHEMBL3218107 0.78 HRH4 (0.49) HRH4HTR2CMALT1GBA1HSD11B1
SCHEMBL3223500 0.77 HSD11B1 (0.70) HSD11B1
SCHEMBL3202120 0.77 KDM4E (0.52) MALT1HTR1ADRD2HTR7HSD11B1
SCHEMBL3223172 0.77 ALDH1A1 (0.54) HSD11B1KIF18AGRM5
SCHEMBL3221937 0.73 HSD11B1 (0.51) MALT1HSD11B1KIF18APDE10ACTSS

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 HRH4 3392/4885HTR2C 1366/4885MALT1 556/4885
US-20070219198-A1 11-Beta HSD 1 inhibitors HSD11B1, HSD11B2, HSD3B1 HRH4 2530/4885HTR2C 806/4885MALT1 593/4885

“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.