SCHEMBL6483720

SCHEMBL6483720

C#Cc1cc2ncnc(Nc3ccc4[nH]c(Cc5cccc(OC)c5)nc4c3)c2s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 8/20 0.47
EGFR P00533 13/20 0.43
FLT1 P17948 6/20 0.43
KDR P35968 3/20 0.43
HDAC3 O15379 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
DYRK3 O43781 1/20 0.39
MAP4K4 O95819 1/20 0.39
PDGFRA P16234 1/20 0.39
LTK P29376 1/20 0.39
GRK5 P34947 1/20 0.39
MAPK8 P45983 1/20 0.39
CDK8 P49336 1/20 0.39
CDK7 P50613 1/20 0.39
IRAK1 P51617 1/20 0.39
NEK4 P51957 1/20 0.39
LIMK1 P53667 1/20 0.39
ACVR1 Q04771 1/20 0.39
TNK2 Q07912 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
SCHEMBL6485329 0.88 ERBB2 (0.56) ERBB2EGFRFLT1KDR
SCHEMBL6483679 0.77 EGFR (0.51) ERBB2EGFR
SCHEMBL6497370 0.77 ERBB2 (0.53) ERBB2EGFRFLT1KDR
SCHEMBL6497364 0.77 ERBB2 (0.53) ERBB2EGFRFLT1KDR
Hydrochloric Acid SCHEMBL6494832 0.76 TTBK1 (0.53) ERBB2EGFRFLT1KDRHDAC3
SCHEMBL6496925 0.75 ERBB2 (0.49) ERBB2EGFRFLT1KDR
Hydrochloric Acid SCHEMBL6483333 0.74 ERBB2 (0.47) ERBB2EGFRFLT1KDR
Hydrochloric Acid SCHEMBL6483348 0.73 ERBB2 (0.47) ERBB2EGFRFLT1KDR
Hydrochloric Acid SCHEMBL6481772 0.73 PKM (0.45) ERBB2EGFRFLT1KDRHDAC3
SCHEMBL6494531 0.72 FLT1 (0.52) ERBB2EGFRFLT1KDRAURKB

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-20050009845-A1 Thienopyrimidine compounds as protein tyrosine kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2005-01-13 US claimed
EP-1463507-A1 THIENOPYRIMIDINE COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS SmithKline Beecham Corporation (US) 2004-10-06 EP claimed
WO-2003053446-A1 THIENOPYRIMIDINE COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-07-03 WO claimed
US-20050009845-A1 Thienopyrimidine compounds as protein tyrosine kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2005-01-13 US disclosed
EP-1463507-A1 THIENOPYRIMIDINE COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS SmithKline Beecham Corporation (US) 2004-10-06 EP disclosed
WO-2003053446-A1 THIENOPYRIMIDINE COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-07-03 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-20050009845-A1 Thienopyrimidine compounds as protein tyrosine kinase inhibitors ERBB2, ERBB4, ERBB3 ERBB2 1/4885EGFR 20/4885FLT1 561/4885

“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.