SCHEMBL321522

SCHEMBL321522

N#Cc1cccc(-c2ccc(O)c(I)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 1/20 0.56
SLC22A12 Q96S37 1/20 0.56
CLK4 Q9HAZ1 1/20 0.46
HDAC8 Q9BY41 1/20 0.46
PTPN5 P54829 1/20 0.46
PGR P06401 2/20 0.43
PDK2 Q15119 1/20 0.43
APP P05067 1/20 0.42
MAP4K4 O95819 1/20 0.42
GABRG2 P18507 2/20 0.42
GABRB3 P28472 2/20 0.42
GABRA5 P31644 2/20 0.42
GABRA3 P34903 2/20 0.42
GABRA1 P14867 1/20 0.42
CHEK1 O14757 1/20 0.41
TTR P02766 1/20 0.41
ALB P02768 1/20 0.41
MMP12 P39900 1/20 0.41
MMP13 P45452 1/20 0.41
IKBKB O14920 1/20 0.41

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
SCHEMBL2785702 0.84 MMP3 (0.55) XDHSLC22A12HDAC8PTPN5PGR
SCHEMBL10248395 0.79 HSD17B1 (0.59) XDHSLC22A12CLK4HDAC8PTPN5
SCHEMBL7125883 0.79 MMP3 (0.66) TTRALB
SCHEMBL178073 0.79 TTR (0.58) TTRALBENPP2
SCHEMBL2154026 0.79 CLK4 (0.65) XDHSLC22A12CLK4PTPN5PGR
SCHEMBL322948 0.78 MMP3 (0.63) XDHSLC22A12CLK4HDAC8PTPN5
SCHEMBL18874455 0.78 CLK4 (0.52) XDHSLC22A12CLK4PTPN5PGR
SCHEMBL27787243 0.77 CLK4 (0.63) XDHSLC22A12CLK4PTPN5PGR
SCHEMBL19880348 0.77 APP (0.55) APPGABRA1
SCHEMBL5844552 0.76 XDH (0.60) XDHSLC22A12CLK4HDAC8PTPN5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2590951-B1 BENZENESULFONAMIDES USEFUL AS SODIUM CHANNEL INHIBITORS PFIZER LTD (GB) 2015-01-07 EP disclosed
EP-2590951-B1 BENZENESULFONAMIDES USEFUL AS SODIUM CHANNEL INHIBITORS PFIZER LTD (GB) 2015-01-07 EP disclosed
US-8772293-B2 Chemical compounds PFIZER LIMITED (GB) 2014-07-08 US disclosed
US-8772293-B2 Chemical compounds PFIZER LIMITED (GB) 2014-07-08 US disclosed
US-8772293-B2 Chemical compounds PFIZER LIMITED (GB) 2014-07-08 US disclosed
EP-2590951-A1 BENZENESULFONAMIDES USEFUL AS SODIUM CHANNEL INHIBITORS Pfizer Limited (GB) 2013-05-15 EP disclosed
WO-2012004743-A1 BENZENESULFONAMIDES USEFUL AS SODIUM CHANNEL INHIBITORS PFIZER LIMITED (GB) 2012-01-12 WO disclosed
US-20120010182-A1 Chemical Compounds ICAGEN INC. (US) 2012-01-12 US disclosed
US-20120010182-A1 Chemical Compounds ICAGEN INC. (US) 2012-01-12 US disclosed
US-20120010182-A1 Chemical Compounds ICAGEN INC. (US) 2012-01-12 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-20120010182-A1 Chemical Compounds SCN1A, SCN1B, CACNA1E XDH 2540/4885SLC22A12 2912/4885CLK4 4567/4885

“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.