SCHEMBL711709

SCHEMBL711709

O=S(=O)(Nc1nccs1)c1ccc(Nc2nccc(OCc3ccccc3F)n2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 5/20 0.61
CDK9 P50750 5/20 0.61
ALOX12 P18054 1/20 0.54
IKBKB O14920 1/20 0.53
SCN1A P35498 2/20 0.52
SCN5A Q14524 2/20 0.52
SCN8A Q9UQD0 2/20 0.52
PKM P14618 2/20 0.52
EGFR P00533 1/20 0.48
KDR P35968 1/20 0.48
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SYK P43405 1/20 0.46
SCN3A Q9NY46 1/20 0.46
SCN1B Q07699 1/20 0.46
CCNA2 P20248 1/20 0.46
CDK2 P24941 1/20 0.46
CCNA1 P78396 1/20 0.46

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
SCHEMBL712458 0.87 CCNT1 (0.61) CCNT1CDK9IKBKBSCN1ASCN5A
SCHEMBL711574 0.81 CCNT1 (0.59) CCNT1CDK9IKBKBSCN1ASCN5A
SCHEMBL713138 0.81 SCN3A (0.60) CCNT1CDK9IKBKBSYKSCN3A
SCHEMBL713573 0.80 CCNT1 (0.70) CCNT1CDK9IKBKBPKMEGFR
SCHEMBL712626 0.77 CCNA2 (0.70) CCNT1CDK9IKBKBSCN1ASCN8A
SCHEMBL713988 0.76 ALDH1A1 (0.64) CCNT1CDK9IKBKBSCN1ASCN5A
SCHEMBL4146308 0.74 CCNT1 (0.66) CCNT1CDK9IKBKBPKMEGFR
Hydrochloric Acid SCHEMBL8933679 0.72 EGFR (0.60) CCNT1CDK9IKBKBSCN1ASCN5A
SCHEMBL16646058 0.70 ALOX12 (1.00) ALOX12PKMMEN1ALDH1A1KMT2A
SCHEMBL13154425 0.69 ALDH1A1 (0.71) PKMMEN1ALDH1A1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124610-B2 Sodium channel inhibitors ICAGEN INC. (US) 2012-02-28 US claimed
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 CCNT1 3878/4885CDK9 2777/4885ALOX12 1666/4885

“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.