SCHEMBL4476179

SCHEMBL4476179

N#Cc1ccc(Nc2nc3ncnc(Cl)c3s2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 5/20 0.46
ADORA2A P29274 4/20 0.46
ADORA1 P30542 2/20 0.46
EGFR P00533 7/20 0.45
TRPV1 Q8NER1 2/20 0.42
DYRK1A Q13627 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
CSNK1D P48730 1/20 0.40
CSNK1G2 P78368 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
VCP P55072 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
PSMD14 O00487 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL4479462 0.81 EGFR (0.64) ADORA3ADORA2AADORA1EGFRTRPV1
SCHEMBL13675051 0.79 EGFR (0.78) EGFRTRPV1
SCHEMBL13675195 0.78 EGFR (0.77) EGFRTRPV1DYRK1A
SCHEMBL4483368 0.76 EGFR (0.69) EGFRMEN1KMT2A
SCHEMBL13675052 0.74 EGFR (0.59) EGFRTRPV1
SCHEMBL14462120 0.71 EGFR (0.56) EGFR
SCHEMBL9726894 0.69 ABCG2 (0.54) EGFRDYRK1ADYRK1BABCG2GSK3B
SCHEMBL1182248 0.68 SYK (0.52) ADORA3DYRK1AABCG2GSK3BKDM4E
SCHEMBL1881253 0.68 CDC7 (0.61) ADORA3DYRK1AABCG2GSK3BKDM4E
SCHEMBL1821911 0.66 NPC1 (0.69) CSNK1DCSNK1G2ABCG2MEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7605154-B2 ATP-protein kinase inhibitors; cytomegalovirus; contraceptive agents; cancer; N7-(3-ethynyl-phenyl)-N2-(4-piperidin-1-ylmethyl-phenyl)-thiazolo[4,5-d]pyrimidine-2,7-diamine JANSSEN PHARMACEUTICA N.V. (BE) 2009-10-20 US disclosed
US-7605154-B2 ATP-protein kinase inhibitors; cytomegalovirus; contraceptive agents; cancer; N7-(3-ethynyl-phenyl)-N2-(4-piperidin-1-ylmethyl-phenyl)-thiazolo[4,5-d]pyrimidine-2,7-diamine JANSSEN PHARMACEUTICA N.V. (BE) 2009-10-20 US disclosed
EP-1912639-A2 THIAZOLOPYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-04-23 EP disclosed
US-20070185139-A1 Thiazolopyrimidine kinase inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2007-08-09 US disclosed
US-20070185139-A1 Thiazolopyrimidine kinase inhibitors JANSSEN PHARMACEUTICA, N.V. (BE) 2007-08-09 US disclosed
WO-2007019191-A2 THIAZOLOPYRIMIDINE KINASE INHIBITORS JANSSEN PHARMACEUTICA, N.V. (BE) 2007-02-15 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-20070185139-A1 Thiazolopyrimidine kinase inhibitors ABL1, MAP3K19, PI4KB ADORA3 2137/4885ADORA2A 1956/4885ADORA1 2205/4885

“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.