SCHEMBL92379

SCHEMBL92379

CCc1nc(Cc2ccccc2)no1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
TSHR P16473 2/20 0.57
KMT2A Q03164 4/20 0.56
MAPT P10636 3/20 0.56
L3MBTL1 Q9Y468 6/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
LMNA P02545 3/20 0.50
CHUK O15111 1/20 0.50
TXNRD1 Q16881 1/20 0.50
NOX4 Q9NPH5 1/20 0.50
HTT P42858 1/20 0.50
ALDH1A1 P00352 5/20 0.49
MEN1 O00255 2/20 0.49
GLA P06280 1/20 0.45
KDM4E B2RXH2 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
SCHEMBL10264767 0.86 MAPK1 (0.55) MAPK1TDP1TSHRKMT2AMAPT
SCHEMBL24264721 0.83 KMT2A (0.48) MAPK1TDP1TSHRKMT2AMAPT
SCHEMBL19265691 0.83 MAPK1 (0.55) MAPK1TDP1TSHRKMT2AMAPT
SCHEMBL4836129 0.83 MAPT (0.45) MAPK1TDP1TSHRKMT2AMAPT
SCHEMBL6528316 0.82 MAPK1 (0.57) MAPK1TDP1TSHRKMT2AMAPT
SCHEMBL11638729 0.82 MAPK1 (0.61) MAPK1TDP1TSHRKMT2AMAPT
SCHEMBL26416251 0.82 MAPK1 (0.70) MAPK1TDP1TSHRKMT2AMAPT
SCHEMBL7979628 0.82 MAPK1 (0.57) MAPK1TDP1TSHRKMT2AMAPT
SCHEMBL10202922 0.81 MAPK1 (0.54) MAPK1TDP1TSHRKMT2AMAPT
Hydrochloric Acid SCHEMBL12478354 0.81 MAPK1 (0.56) MAPK1TDP1TSHRKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3275870-B1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD SCIENCES INC (US) 2020-02-05 EP disclosed
EP-3275870-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS Gilead Sciences, Inc. (US) 2018-01-31 EP disclosed
EP-2707361-B1 FUSED HETEROCYCLIC COMPOUNDS AS SODIUM CHANNEL MODULATORS GILEAD SCIENCES INC (US) 2017-08-23 EP disclosed
US-9682998-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2017-06-20 US disclosed
US-20160362421-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD SCIENCES, INC. 2016-12-15 US disclosed
US-9403782-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2016-08-02 US disclosed
US-9139609-B2 C-4″ position substituted macrolide derivative TAISHO PHARMACEUTICAL CO., LTD. (JP) 2015-09-22 US disclosed
US-9115096-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2015-08-25 US disclosed
US-8703759-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2014-04-22 US disclosed
US-20140046043-A1 C-4\" POSITION SUBSTITUTED MACROLIDE DERIVATIVE MEIJI SEIKA PHARMA CO., LTD. (JP) 2014-02-13 US disclosed
US-8129415-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-03-06 US disclosed
US-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-07-30 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 (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-20090192196-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 MAPK1 2712/4885TDP1 1830/4885TSHR 1440/4885
US-20160362421-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, CACNA1A, KCNH2 MAPK1 1475/4885TDP1 3177/4885TSHR 1832/4885
US-20140046043-A1 C-4\" POSITION SUBSTITUTED MACROLIDE DERIVATIVE MRPL21, MRPS34, MRPL37 MAPK1 2555/4885TDP1 2075/4885TSHR 2520/4885

“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.