SCHEMBL709774

SCHEMBL709774

CCOC(=O)C1(C)C=C(Nc2ccc(S(=O)(=O)Nc3nccs3)cc2)C(=O)N1c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.64
ALDH1A1 P00352 4/20 0.64
TP53 P04637 1/20 0.63
KDM4E B2RXH2 3/20 0.58
LMNA P02545 1/20 0.57
ADRB2 P07550 1/20 0.57
PLEC Q15149 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
HPGD P15428 1/20 0.55
RAB9A P51151 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
SCN3A Q9NY46 2/20 0.47
PKM P14618 2/20 0.47
SCN1A P35498 1/20 0.47
SCN1B Q07699 1/20 0.47
SCN5A Q14524 1/20 0.47
SCN8A Q9UQD0 1/20 0.47
POLB P06746 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
SCHEMBL28641973 0.80 TP53 (0.85) MAPTALDH1A1TP53KDM4ELMNA
SCHEMBL28923256 0.73 ALDH1A1 (0.83) MAPTALDH1A1TP53KDM4ELMNA
SCHEMBL28639448 0.73 ALDH1A1 (0.83) MAPTALDH1A1TP53KDM4ELMNA
SCHEMBL28635758 0.72 ALDH1A1 (1.00) MAPTALDH1A1TP53KDM4ELMNA
SCHEMBL28637593 0.70 ALDH1A1 (0.73) MAPTALDH1A1TP53KDM4ELMNA
SCHEMBL28981422 0.70 SCN1A (0.67) ALDH1A1KDM4ELMNASMN1; SMN2MEN1
SCHEMBL28631363 0.70 ALDH1A1 (0.77) MAPTALDH1A1TP53KDM4ELMNA
SCHEMBL713753 0.69 CYP2C9 (0.57) MAPTALDH1A1KDM4ELMNANPSR1
SCHEMBL28631542 0.69 ALDH1A1 (0.77) MAPTALDH1A1TP53KDM4ELMNA
SCHEMBL712299 0.68 SCN9A (0.68) ALDH1A1SMN1; SMN2HPGDMEN1KMT2A

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-8124610-B2 Sodium channel inhibitors ICAGEN INC. (US) 2012-02-28 US disclosed
US-20090023740-A1 SODIUM CHANNEL INHIBITORS ICAGEN (US) 2009-01-22 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-20090023740-A1 SODIUM CHANNEL INHIBITORS TRPV1, SCN1A, SCN2A MAPT 2394/4885ALDH1A1 3333/4885TP53 4844/4885

“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.