SCHEMBL323510

SCHEMBL323510

Oc1ccc(-c2cccc(C(F)(F)F)c2)cc1I

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.48
MAOB P27338 1/20 0.46
CNR2 P34972 2/20 0.46
MAPT P10636 1/20 0.46
KDM1A O60341 1/20 0.45
PGR P06401 1/20 0.43
ASIC3 Q9UHC3 1/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
APP P05067 1/20 0.42
PTPN1 P18031 1/20 0.41
CA12 O43570 1/20 0.41
CA9 Q16790 1/20 0.41
ERAP1 Q9NZ08 1/20 0.41
CES2 O00748 1/20 0.41
MGLL Q99685 1/20 0.41
IDO1 P14902 1/20 0.41
NOTUM Q6P988 1/20 0.41
PARP10 Q53GL7 1/20 0.40
PARP11 Q9NR21 1/20 0.40

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
SCHEMBL17293845 0.79 KIF11 (0.48) KIF11MAOBCNR2MAPTKDM1A
SCHEMBL13549883 0.79 ESR2 (0.59) KIF11MAOBCNR2MAPTKDM1A
SCHEMBL365939 0.79 MEN1 (0.48) KIF11MAPTALOX15CES2MGLL
SCHEMBL1263144 0.79 TSHR (0.58) KIF11MAOBKDM1APGRASIC3
SCHEMBL29678302 0.79 TSHR (0.58) KIF11MAOBKDM1APGRASIC3
SCHEMBL322980 0.78 KIF11 (0.63) KIF11MAOBKDM1APGRASIC3
SCHEMBL26827704 0.77 MAOB (0.62) KIF11MAOBKDM1APGRASIC3
Ammonia Solution, Strong SCHEMBL20472961 0.77 MAOB (0.56) KIF11MAOBKDM1APGRASIC3
SCHEMBL19880348 0.77 APP (0.55) MAPTALOX15ALOX12APP
SCHEMBL322142 0.76 RORB (0.49) CNR2MAPTALOX15ALOX12

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 KIF11 3321/4885MAOB 3011/4885CNR2 242/4885

“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.