SCHEMBL3379345

SCHEMBL3379345

CS(=O)(=O)Nc1ccc(-c2ccc(OC(F)(F)F)cc2)c(Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.68
EPHX2 P34913 1/20 0.58
NR1H4 Q96RI1 1/20 0.58
ABL1 P00519 13/20 0.53
BCR P11274 1/20 0.53
CYP17A1 P05093 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL3377794 0.86 DHODH (0.56) KIF11EPHX2NR1H4ABL1CYP17A1
SCHEMBL3375773 0.86 KIF11 (0.70) KIF11EPHX2NR1H4ABL1BCR
SCHEMBL3372908 0.85 KIF11 (0.68) KIF11EPHX2NR1H4ABL1BCR
SCHEMBL3376228 0.84 EPHX2 (0.55) KIF11EPHX2CYP17A1GAAHPGD
SCHEMBL3378630 0.84 KIF11 (0.67) KIF11EPHX2NR1H4ABL1BCR
SCHEMBL3379334 0.83 KIF11 (0.46) KIF11EPHX2NR1H4ABL1BCR
SCHEMBL3375971 0.83 KIF11 (0.66) KIF11EPHX2NR1H4GAAHPGD
SCHEMBL3378495 0.82 KIF11 (1.00) KIF11EPHX2NR1H4ABL1BCR
SCHEMBL3378764 0.81 PTGS2 (0.51) KIF11CYP17A1GAAHPGDMAPK1
SCHEMBL3378931 0.81 KIF11 (0.67) KIF11CYP17A1GAAHPGDMAPK1

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 3561/4885EPHX2 1898/4885NR1H4 2215/4885

“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.