SCHEMBL1319792

SCHEMBL1319792

Cc1ccc2nc(NC(=O)Cc3ccccc3)c(-c3ccc(F)cc3)n2c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 3/20 0.52
NR1H4 Q96RI1 3/20 0.52
GABRA1 P14867 1/20 0.47
GABRB2 P47870 1/20 0.47
ADORA3 P0DMS8 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
ADORA1 P30542 2/20 0.44
ADORA2A P29274 1/20 0.44
HPGD P15428 2/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 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
SCHEMBL1321328 0.91 MAPK14 (0.53) MAPK14GABRA1GABRB2ADORA3SMN1; SMN2
SCHEMBL1319548 0.89 SMN1; SMN2 (0.52) MAPK14GABRA1GABRB2SMN1; SMN2GAA
SCHEMBL1321208 0.88 MAPK14 (0.44) MAPK14NR1H4GABRA1GABRB2SMN1; SMN2
SCHEMBL1320928 0.88 MAPK14 (0.49) MAPK14ADORA3SMN1; SMN2KDM4EALDH1A1
SCHEMBL1320267 0.87 MAPK14 (0.48) MAPK14ADORA3SMN1; SMN2GAAKDM4E
SCHEMBL1320360 0.86 MAPK14 (0.48) MAPK14NR1H4ADORA3ADORA1ADORA2A
SCHEMBL1320678 0.86 KMT2A (0.47) MAPK14GABRA1GABRB2SMN1; SMN2GAA
SCHEMBL1321279 0.85 MAPK14 (0.48) MAPK14ADORA3ADORA1ADORA2A
SCHEMBL1319710 0.84 MAPK14 (0.52) MAPK14ADORA3SMN1; SMN2KDM4EALDH1A1
SCHEMBL1320095 0.84 MAPK14 (0.48) MAPK14ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9018208-B2 Heterocycles as potassium channel modulators ICAGEN INC. (US) 2015-04-28 US disclosed
US-20130143889-A1 Heterocycles As Potassium Channel Modulators ICAGEN INC. (US) 2013-06-06 US disclosed
US-8431608-B2 Heterocycles as potassium channel modulators ICAGEN INC. (US) 2013-04-30 US disclosed
EP-2536718-A1 HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS Icagen, Inc. (US) 2012-12-26 EP disclosed
US-8058274-B2 Heterocycles as potassium channel modulators ICAGEN, INC. (US) 2011-11-15 US disclosed
WO-2011102964-A1 HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS ICAGEN, INC. (US) 2011-08-25 WO disclosed
US-20100240663-A1 HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS ICAGEN, INC. (US) 2010-09-23 US disclosed
EP-2178373-A1 HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS Icagen, Inc. (US) 2010-04-28 EP disclosed
US-20090062290-A1 HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS ICAGEN, INC. (US) 2009-03-05 US disclosed
WO-2009026254-A1 HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS ICAGEN, INC. (US) 2009-02-26 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 (3 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-20130143889-A1 Heterocycles As Potassium Channel Modulators KCNK10, KCNK9, KCNJ2 MAPK14 1648/4885NR1H4 2524/4885GABRA1 249/4885
US-20090062290-A1 HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS KCNJ2, KCNK2, KCNK17 MAPK14 1612/4885NR1H4 2594/4885GABRA1 246/4885
US-20100240663-A1 HETEROCYCLES AS POTASSIUM CHANNEL MODULATORS KCNJ2, KCNK2, KCNK17 MAPK14 1612/4885NR1H4 2594/4885GABRA1 246/4885

“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.