SCHEMBL937151

SCHEMBL937151

FC(F)(F)c1ccc(C#Cc2ccc3nnc(Oc4ccccc4)n3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 5/20 0.39
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LRRK2 Q5S007 2/20 0.35
GRM5 P41594 4/20 0.34
MAPK14 Q16539 1/20 0.32
SCN1A P35498 1/20 0.32
SCN2A Q99250 1/20 0.32
GAA P10253 1/20 0.31
KIF11 P52732 1/20 0.31
TSHR P16473 1/20 0.31

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
SCHEMBL938675 0.76 SCN5A (0.66) SCN5AKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL937222 0.73 SCN5A (0.50) SCN5AALDH1A1GRM5MAPK14SCN1A
SCHEMBL936594 0.72 SCN5A (0.47) SCN5AKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL937258 0.70 SCN5A (0.50) SCN5AKDM4EALDH1A1SMN1; SMN2HSD17B10
SCHEMBL936395 0.70 SCN5A (0.62) SCN5ASCN1ASCN2A
SCHEMBL936828 0.68 SCN5A (0.40) SCN5AGRM5MAPK14SCN1ASCN2A
SCHEMBL2830955 0.68 ALDH1A1 (0.59) ALDH1A1GRM5KIF11TSHR
SCHEMBL16331801 0.68 PIM1 (0.54) SCN5AKDM4EHSD17B10LRRK2GRM5
SCHEMBL937305 0.65 SCN5A (0.58) SCN5AKDM4EHSD17B10LRRK2SCN1A
SCHEMBL254896 0.65 TSHR (0.59) ALDH1A1MAPK14KIF11TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2464645-B1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD SCIENCES INC (US) 2017-07-05 EP claimed
US-8952034-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2015-02-10 US claimed
US-8754103-B2 2014-06-17 US claimed
EP-2464645-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS Gilead Palo Alto, Inc. (US) 2012-06-20 EP claimed
WO-2011014462-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2011-02-03 WO claimed
US-20110021521-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2011-01-27 US claimed
EP-2464645-B1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD SCIENCES INC (US) 2017-07-05 EP disclosed
EP-2464645-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS Gilead Palo Alto, Inc. (US) 2012-06-20 EP disclosed
WO-2011014462-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2011-02-03 WO 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-20110021521-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, KCNH2, KCNA3 SCN5A 52/4885KDM4E 2541/4885ALDH1A1 2432/4885

“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.