SCHEMBL3377400

SCHEMBL3377400

CS(=O)(=O)Nc1ccc(-c2ccc(Cl)c(F)c2)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.48
PGR P06401 2/20 0.47
CYP17A1 P05093 2/20 0.47
KIT P10721 5/20 0.46
HAVCR2 Q8TDQ0 1/20 0.45
SCN9A Q15858 1/20 0.45
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
ALOX5AP P20292 1/20 0.44
FEN1 P39748 1/20 0.44
PTGS2 P35354 1/20 0.44
NR3C1 P04150 1/20 0.42
NR3C2 P08235 1/20 0.42
AR P10275 1/20 0.42

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
SCHEMBL3376954 0.91 KIF11 (0.48) KIF11PGRCYP17A1KITHAVCR2
SCHEMBL3932771 0.88 KIF11 (0.50) KIF11PGRCYP17A1KITGAA
SCHEMBL3376946 0.85 CYP17A1 (0.51) KIF11CYP17A1KITSCN9APTGS2
SCHEMBL3375785 0.85 KIF11 (0.59) KIF11CYP17A1SCN9ANR3C1AR
SCHEMBL3377016 0.85 KIF11 (0.64) KIF11SCN9AHPGDPTGS2
SCHEMBL3374747 0.83 KIF11 (0.51) KIF11PGRCYP17A1KITHAVCR2
SCHEMBL3379148 0.83 KDM1A (0.55) KIF11CYP17A1KITHPGDPTGS2
SCHEMBL3377083 0.80 PTGS2 (0.52) KIF11CYP17A1GAAHPGDMAPK1
SCHEMBL13369737 0.79 CYP17A1 (0.54) KIF11PGRCYP17A1KITGAA
SCHEMBL29788021 0.79 CYP17A1 (0.54) KIF11PGRCYP17A1KITGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US claimed
WO-2010056527-A2 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-20 WO claimed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 US claimed
US-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US disclosed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 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-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, HCN4, KCNH2 KIF11 3561/4885PGR 4327/4885CYP17A1 3984/4885

“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.