SCHEMBL4863945

SCHEMBL4863945

COc1ccccc1Cc1cc(Cl)ccc1NS(=O)(=O)c1ccccc1OC

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.60
NPC1 O15118 1/20 0.60
CASP1 P29466 1/20 0.51
CASP7 P55210 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HSD17B10 Q99714 1/20 0.51
WDR5 P61964 4/20 0.50
PTGES2 Q9H7Z7 2/20 0.50
ACLY P53396 1/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 1/20 0.48
IDO1 P14902 1/20 0.46
ALPL P05186 1/20 0.46
SLC22A12 Q96S37 1/20 0.46
MYC P01106 1/20 0.46
TP53 P04637 1/20 0.46
KDM4E B2RXH2 1/20 0.45
GAA P10253 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
SCHEMBL3252007 0.93 TSHR (0.58) TSHRNPC1CASP1CASP7SMN1; SMN2
SCHEMBL4865757 0.87 TSHR (0.57) TSHRNPC1CASP1CASP7SMN1; SMN2
SCHEMBL3256105 0.85 ALDH1A1 (0.65) TSHRNPC1SMN1; SMN2MEN1KMT2A
SCHEMBL27908886 0.82 TSHR (0.69) TSHRNPC1WDR5ACLYMEN1
SCHEMBL22005134 0.80 NPC1 (0.66) TSHRNPC1WDR5ACLYMEN1
SCHEMBL3251138 0.77 GAA (0.47) TSHRNPC1SMN1; SMN2HSD17B10MEN1
SCHEMBL4626572 0.76 IDO1 (0.62) SMN1; SMN2MEN1KMT2AALDH1A1IDO1
SCHEMBL7572911 0.76 NPC1 (1.00) TSHRNPC1WDR5MEN1KMT2A
SCHEMBL7594909 0.75 NPC1 (0.89) TSHRNPC1WDR5MEN1KMT2A
SCHEMBL3247467 0.74 LMNA (0.58) CASP1SMN1; SMN2HSD17B10KMT2AALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7396958-B2 Sulphonamide derivatives, their preparation and their therapeutic application SANOFI AVENTIS (FR) 2008-07-08 US disclosed
US-20070185136-A1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI-AVENTIS (FR) 2007-08-09 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 (1 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-20070185136-A1 SULPHONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION HCRTR2, GIPR, SSTR2 TSHR 29/4885NPC1 3528/4885CASP1 4035/4885

“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.