SCHEMBL937590

SCHEMBL937590

c1ccc(Oc2ccc(-c3ccc4nncn4c3)cc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.62
DNMT1 P26358 1/20 0.50
ALDH1A3 P47895 6/20 0.43
TLR8 Q9NR97 1/20 0.43
ALDH1A1 P00352 2/20 0.41
ALDH1A2 O94788 1/20 0.41
MAPK14 Q16539 1/20 0.41
TSHR P16473 2/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SLC2A1 P11166 1/20 0.38
LTA4H P09960 3/20 0.38
GSTP1 P09211 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SCN4A P35499 1/20 0.37
RET P07949 1/20 0.37
PIM1 P11309 1/20 0.37

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
SCHEMBL11379662 0.87 SCN5A (0.59) SCN5ADNMT1ALDH1A3ALDH1A1ALDH1A2
SCHEMBL22044433 0.84 MEN1 (0.51) SCN5ADNMT1ALDH1A3ALDH1A1ALDH1A2
SCHEMBL11491065 0.81 SCN5A (0.66) SCN5ADNMT1ALDH1A3MAPK14NPC1
SCHEMBL2016682 0.78 GRM5 (0.46) SCN5ATLR8ALDH1A1SMN1; SMN2LTA4H
SCHEMBL19781793 0.77 SCN5A (0.61) SCN5ADNMT1ALDH1A3MAPK14TGFBR1
SCHEMBL936850 0.77 SCN5A (1.00) SCN5ADNMT1ALDH1A1MAPK14NPSR1
SCHEMBL11476887 0.75 SCN5A (0.58) SCN5ADNMT1ALDH1A3ALDH1A1ALDH1A2
SCHEMBL11486274 0.75 SCN5A (0.58) SCN5ADNMT1ALDH1A3ALDH1A1ALDH1A2
SCHEMBL11384331 0.75 MAPK14 (0.64) SCN5ADNMT1ALDH1A3ALDH1A1ALDH1A2
SCHEMBL11474506 0.75 SCN5A (0.58) SCN5ADNMT1ALDH1A3ALDH1A1MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8952034-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2015-02-10 US disclosed
US-8754103-B2 2014-06-17 US disclosed
US-20110021521-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2011-01-27 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-20110021521-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, KCNH2, KCNA3 SCN5A 52/4885DNMT1 4222/4885ALDH1A3 2321/4885

“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.