SCHEMBL712412

SCHEMBL712412

O=S(=O)(Nc1nccs1)c1ccc(Br)c2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55
ALDH1A1 P00352 2/20 0.51
USP2 O75604 1/20 0.50
MAPT P10636 1/20 0.50
ESR2 Q92731 1/20 0.50
HSD17B10 Q99714 1/20 0.50
SCN9A Q15858 3/20 0.48
LMNA P02545 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP2C9 P11712 1/20 0.48
EDNRA P25101 1/20 0.48
SLC6A4 P31645 1/20 0.48
ADRA1A P35348 1/20 0.48
PRMT6 Q96LA8 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP1A2 P05177 1/20 0.47
SCN1A P35498 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
SCHEMBL1862744 0.84 LMNA (0.55) ALDH1A1USP2MAPTESR2HSD17B10
SCHEMBL1855127 0.78 EDNRA (0.55) ALDH1A1USP2MAPTESR2HSD17B10
SCHEMBL1858135 0.78 KMT2A (0.57) KMT2AMEN1SCN9AEDNRASCN1A
SCHEMBL1863212 0.75 KDM4E (0.51) ALDH1A1USP2MAPTESR2HSD17B10
SCHEMBL13007609 0.75 SCN3A (0.47) KMT2AMEN1ALDH1A1TDP1SMN1; SMN2
SCHEMBL1855793 0.74 USP2 (0.46) ALDH1A1USP2MAPTESR2HSD17B10
SCHEMBL1492421 0.74 ALDH1A1 (0.60) KMT2AMEN1ALDH1A1USP2MAPT
SCHEMBL1094208 0.74 SCN9A (0.61) USP2MAPTESR2HSD17B10SCN9A
SCHEMBL22567942 0.74 USP2 (0.70) ALDH1A1USP2MAPTESR2HSD17B10
SCHEMBL29668582 0.74 SCN9A (0.61) USP2MAPTESR2HSD17B10SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124610-B2 Sodium channel inhibitors ICAGEN INC. (US) 2012-02-28 US disclosed
US-8124610-B2 Sodium channel inhibitors ICAGEN INC. (US) 2012-02-28 US disclosed
US-8124610-B2 Sodium channel inhibitors ICAGEN INC. (US) 2012-02-28 US disclosed
EP-2173743-A2 SODIUM CHANNEL INHIBITORS Icagen, Inc. (US) 2010-04-14 EP disclosed
US-20090023740-A1 SODIUM CHANNEL INHIBITORS ICAGEN (US) 2009-01-22 US disclosed
US-20090023740-A1 SODIUM CHANNEL INHIBITORS ICAGEN (US) 2009-01-22 US disclosed
US-20090023740-A1 SODIUM CHANNEL INHIBITORS ICAGEN (US) 2009-01-22 US disclosed
WO-2009012242-A2 SODIUM CHANNEL INHIBITORS ICAGEN, INC. (US) 2009-01-22 WO disclosed
WO-2009012242-A2 SODIUM CHANNEL INHIBITORS ICAGEN, INC. (US) 2009-01-22 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 (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-20090023740-A1 SODIUM CHANNEL INHIBITORS TRPV1, SCN1A, SCN2A KMT2A 1945/4885MEN1 4426/4885RXFP1 4010/4885

“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.