SCHEMBL3223665

SCHEMBL3223665

Cc1ccc(S(=O)(=O)N2CCC(Oc3ccccc3Br)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 6/20 0.49
KDM4E B2RXH2 1/20 0.49
LMNA P02545 2/20 0.48
HTT P42858 2/20 0.48
GAA P10253 3/20 0.48
USP2 O75604 1/20 0.48
POLB P06746 1/20 0.48
PKM P14618 1/20 0.48
PTGDR Q13258 2/20 0.48
HTR2C P28335 2/20 0.47
HTR2A P28223 1/20 0.47
KCNH2 Q12809 1/20 0.47

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
SCHEMBL3210439 0.87 MEN1 (0.57) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL3222003 0.86 HTR2C (0.62) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL3213292 0.86 MAPT (0.60) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL3201810 0.85 HTR2C (0.63) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL3212962 0.84 PTGDR (0.57) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL3222876 0.83 MCOLN3 (0.59) SMN1; SMN2MAPTKDM4ELMNAHTT
SCHEMBL24590696 0.83 PTGDR (0.56) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL3210436 0.83 MEN1 (0.53) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL3219582 0.82 SCD (0.53) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL3222938 0.82 MEN1 (0.63) MEN1KMT2ASMN1; SMN2MAPTALDH1A1

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 1609/4885SMN1; SMN2 3575/4885
US-20070219198-A1 11-Beta HSD 1 inhibitors HSD11B1, HSD11B2, HSD3B1 MEN1 1687/4885KMT2A 1591/4885SMN1; SMN2 3686/4885

“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.