SCHEMBL326404

SCHEMBL326404

Oc1ccc(-c2ccc(C(F)(F)F)nc2)cc1I

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.46
PI4KB Q9UBF8 2/20 0.46
PIK3CD O00329 1/20 0.46
PIK3CB P42338 1/20 0.46
PI4KA P42356 1/20 0.46
PIK3CG P48736 1/20 0.46
TRPV4 Q9HBA0 1/20 0.42
MAP4K4 O95819 1/20 0.41
KCNH2 Q12809 1/20 0.41
MINK1 Q8N4C8 1/20 0.41
PDE10A Q9Y233 1/20 0.39
METAP2 P50579 1/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
DAO P14920 1/20 0.35

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
SCHEMBL1690559 0.81 NOTUM (0.44) MAP4K4
SCHEMBL30536021 0.75 KIF11 (0.52) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL322603 0.75 KIF11 (0.52) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL18356741 0.75 HSD17B1 (0.60) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL15674520 0.75 IDO1 (0.49) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL1690921 0.75 KCNH2 (0.42) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL28032643 0.74 MEN1 (0.55) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL19880348 0.74 APP (0.55)
SCHEMBL23263925 0.74 PIK3CA (0.43) PIK3CAPI4KBPIK3CDPIK3CBPI4KA
SCHEMBL15674535 0.74 KCNH2 (0.47) PIK3CAPI4KBPIK3CDPIK3CBPI4KA

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 11 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
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 PIK3CA 1342/4885PI4KB 2896/4885PIK3CD 2392/4885

“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.