SCHEMBL713191

SCHEMBL713191

O=S(=O)(Nc1nccs1)c1ccc(Nc2nc(CNCc3ccc(C(F)(F)F)cc3)cs2)cc1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SCN3A Q9NY46 7/20 0.65
NAMPT P43490 1/20 0.48
POLB P06746 1/20 0.47
SCN9A Q15858 5/20 0.45
ALDH1A1 P00352 2/20 0.45
PKM P14618 1/20 0.45
ATM Q13315 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
EGFR P00533 1/20 0.43
KDR P35968 1/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
CYP2C9 P11712 1/20 0.43
EDNRA P25101 1/20 0.43
SLC6A4 P31645 1/20 0.43
ADRA1A P35348 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL714319 0.88 LMNA (0.58) SCN3ANAMPTSCN9AALDH1A1MEN1
SCHEMBL711140 0.86 RXFP1 (0.55) SCN3ANAMPTALDH1A1PKMMEN1
SCHEMBL710421 0.86 MEN1 (0.47) SCN3ANAMPTPOLBALDH1A1PKM
SCHEMBL711841 0.81 KDM1A (0.64) SCN3ASCN9AALDH1A1PKMATM
SCHEMBL711424 0.80 SCN3A (0.56) SCN3APOLBALDH1A1PKMATM
SCHEMBL713846 0.78 SCN1A (0.56) SCN3APOLBSCN9AALDH1A1PKM
SCHEMBL714055 0.78 PKM (0.54) SCN3ANAMPTPOLBSCN9AALDH1A1
SCHEMBL712663 0.78 LMNA (0.62) SCN3ASCN9AALDH1A1MEN1KMT2A
SCHEMBL712653 0.78 SCN9A (0.61) SCN3ASCN9A
SCHEMBL711624 0.77 SCN3A (0.63) SCN3ANAMPTSCN9AALDH1A1PKM

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 4 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
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
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 SCN3A 7/4885NAMPT 687/4885POLB 4439/4885

“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.