SCHEMBL322547

SCHEMBL322547

Oc1ccc(-c2cccc(C(F)(F)F)n2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.64
POLB P06746 2/20 0.64
HPGD P15428 2/20 0.64
MAPT P10636 1/20 0.64
HSD17B10 Q99714 1/20 0.64
NOTUM Q6P988 1/20 0.46
SYK P43405 1/20 0.46
IDH1 O75874 6/20 0.45
IDH2 P48735 1/20 0.45
AR P10275 1/20 0.44
KIF11 P52732 1/20 0.44
COMT P21964 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NFKB1 P19838 1/20 0.43
GFER P55789 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL22337449 0.83 NOTUM (0.47) NOTUMIDH1IDH2KIF11TGFBR1
SCHEMBL3381636 0.82 MEN1 (0.60) POLBHPGDHSD17B10NOTUMSYK
SCHEMBL2842049 0.81 NOTUM (0.46) ALDH1A1POLBHPGDMAPTHSD17B10
SCHEMBL27174400 0.81 NOTUM (0.43) ALDH1A1POLBHPGDMAPTHSD17B10
SCHEMBL4943174 0.80 MAPT (1.00) ALDH1A1POLBHPGDMAPTHSD17B10
SCHEMBL15624402 0.80 NOTUM (0.58) NOTUMIDH1IDH2GABRA1GABRG2
SCHEMBL30395354 0.80 NOTUM (0.58) NOTUMIDH1IDH2GABRA1GABRG2
SCHEMBL5950610 0.78 MAPT (0.95) ALDH1A1POLBHPGDMAPTHSD17B10
SCHEMBL6235365 0.77 SYK (0.49) NOTUMSYKIDH1IDH2KIF11
SCHEMBL18003107 0.77 NOTUM (0.43) NOTUMIDH1IDH2KIF11COMT

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 ALDH1A1 557/4885POLB 4229/4885HPGD 3921/4885

“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.