SCHEMBL3640748

SCHEMBL3640748

O=S(=O)(O)c1ccc(I)cn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TET2 Q6N021 2/20 0.40
CA1 P00915 4/20 0.36
CA2 P00918 4/20 0.36
CA12 O43570 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA13 Q8N1Q1 1/20 0.36
CA14 Q9ULX7 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP13 P45452 1/20 0.33
NAPRT Q6XQN6 1/20 0.32
EDNRA P25101 1/20 0.31
F2 P00734 1/20 0.31

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
SCHEMBL713957 0.78 CA12 (0.36) TET2CA1CA2CA12CA4
SCHEMBL3581469 0.78 PIK3CD (0.39) TET2CA1CA2CA12CA4
SCHEMBL8119449 0.76 LMNA (0.44) CA1CA2CA12CA4CA6
SCHEMBL8847357 0.76 KDM4E (0.61) CA1CA2CA12CA4CA6
SCHEMBL2345590 0.75 PSIP1 (0.34) CA1CA2CA12CA4CA6
SCHEMBL29733038 0.74 CCR1 (0.50) CA1CA2CA12CA4CA6
SCHEMBL2633881 0.74 CCR1 (0.50) CA1CA2CA12CA4CA6
SCHEMBL1134478 0.74 CA1 (0.67) CA1CA2CA12CA4CA6
SCHEMBL3387459 0.74 L3MBTL1 (0.42) CA1CA2CA12CA9KDM4E
SCHEMBL4259013 0.74 ALDH1A1 (0.45) CA1CA2CA12CA4CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 TET2 2861/4885CA1 709/4885CA2 157/4885

“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.