SCHEMBL321768

SCHEMBL321768

Oc1cc(Cl)c(-c2ccccc2F)cc1I

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.43
HSD11B1 P28845 1/20 0.40
ACMSD Q8TDX5 1/20 0.37
PIK3CA P42336 1/20 0.37
KCNMA1 Q12791 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CA12 O43570 2/20 0.35
CA9 Q16790 2/20 0.35
MEN1 O00255 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
CHRM1 P11229 1/20 0.34
GPR35 Q9HC97 1/20 0.34
DPP4 P27487 1/20 0.34
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33

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
SCHEMBL322901 0.93 HSP90AA1 (0.40) HSP90AA1HSD11B1ACMSDPIK3CAKCNMA1
SCHEMBL22560893 0.74 HSD17B10 (0.50) HSP90AA1MEN1MAPTKMT2AALDH1A1
SCHEMBL23693567 0.74 HSD11B1 (0.47) HSP90AA1HSD11B1ACMSDPIK3CAKCNMA1
SCHEMBL29886972 0.74 HSD11B1 (0.47) HSP90AA1HSD11B1ACMSDPIK3CAKCNMA1
SCHEMBL323006 0.74 GCGR (0.43) PIK3CAKCNMA1KDM4E
SCHEMBL322242 0.73 ESR2 (0.43) MEN1MAPTKMT2ANPSR1GPR35
SCHEMBL1093924 0.73 TSHR (0.40) HSP90AA1PIK3CAKCNMA1CA9MEN1
SCHEMBL31379545 0.73 TSHR (0.40) HSP90AA1PIK3CAKCNMA1CA9MEN1
SCHEMBL19033931 0.73 HSD11B1 (0.43) HSD11B1KDM4EMEN1MAPTKMT2A
SCHEMBL321960 0.73 ESR1 (0.53) HSD11B1CA12CA9

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 HSP90AA1 3707/4885HSD11B1 2702/4885ACMSD 3142/4885

“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.