SCHEMBL937083

SCHEMBL937083

Cc1c(-c2ccc(OC(F)(F)F)cc2)ccc2nnnn12

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 13/20 0.47
CYP1A2 P05177 4/20 0.47
SCN1A P35498 1/20 0.42
SCN2A Q99250 1/20 0.42
CACNA2D1 P54289 1/20 0.37
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GABBR2 O75899 1/20 0.36
GABBR1 Q9UBS5 1/20 0.36

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
SCHEMBL937670 0.88 SCN5A (0.46) SCN5ACYP1A2SCN1ASCN2ACACNA2D1
SCHEMBL936820 0.83 SCN5A (0.48) SCN5ACYP1A2SCN1ASCN2AHPGD
SCHEMBL937183 0.76 SCN5A (0.58) SCN5ACYP1A2SCN1ASCN2A
SCHEMBL936555 0.71 SCN5A (0.61) SCN5ACYP1A2SCN1ASCN2A
SCHEMBL252836 0.71 SCN5A (0.60) SCN5ACYP1A2SCN1ASCN2A
SCHEMBL21938185 0.70 GPR3 (0.46) SCN5ASCN1ASCN2ANPSR1GABBR2
SCHEMBL967368 0.69 SCN5A (0.42) SCN5ACYP1A2SCN1ASCN2ACACNA2D1
SCHEMBL937481 0.67 CYP1A2 (0.75) SCN5ACYP1A2SCN1ASCN2AHPGD
SCHEMBL938211 0.66 SCN5A (0.54) SCN5ACYP1A2SCN1ASCN2AHPGD
SCHEMBL936526 0.65 SCN5A (0.46) SCN5ASCN1ASCN2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-9371329-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2016-06-21 US disclosed
US-8952034-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2015-02-10 US disclosed
US-20140303158-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD SCIENCES, INC. (US) 2014-10-09 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 (2 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-20140303158-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, KCNH2, KCNA3 SCN5A 52/4885CYP1A2 1580/4885SCN1A 55/4885
US-20110021521-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, KCNH2, KCNA3 SCN5A 52/4885CYP1A2 1580/4885SCN1A 55/4885

“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.