SCHEMBL6497399

SCHEMBL6497399

C=CC(=O)Nc1cccc(Nc2ncnc(NCc3ccc(OCc4ccccc4)cc3)n2)c1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BTK Q06187 14/20 0.58
EGFR P00533 11/20 0.58
JAK3 P52333 4/20 0.58
ERBB2 P04626 1/20 0.57
ITK Q08881 3/20 0.51
SRC P12931 1/20 0.51
BLK P51451 1/20 0.51
JAK2 O60674 1/20 0.49
LYN P07948 1/20 0.49
TEC P42680 1/20 0.49
TXK P42681 1/20 0.49
BMX P51813 1/20 0.49
CD69 Q07108 1/20 0.49
KCNH2 Q12809 1/20 0.47

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
SCHEMBL6484825 0.92 EGFR (0.66) BTKEGFRJAK3ERBB2ITK
SCHEMBL6492634 0.87 EGFR (0.54) BTKEGFRJAK3ERBB2JAK2
SCHEMBL6497404 0.83 BTK (0.57) BTKEGFRJAK3ERBB2ITK
SCHEMBL6482765 0.82 JAK3 (0.57) BTKEGFRJAK3ITKSRC
SCHEMBL6482330 0.81 EGFR (0.62) BTKEGFRJAK3ERBB2ITK
SCHEMBL30423295 0.80 EGFR (0.75) BTKEGFRJAK3ERBB2ITK
SCHEMBL28400978 0.80 EGFR (0.75) BTKEGFRJAK3ERBB2ITK
SCHEMBL6496345 0.79 ERBB2 (0.58) BTKEGFRJAK3ERBB2ITK
SCHEMBL6483467 0.78 ERBB2 (0.58) BTKEGFRJAK3ERBB2ITK
SCHEMBL13165499 0.76 BTK (0.79) BTKEGFRJAK3ITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6881737-B2 Substituted triazinyl acrylamide derivatives and methods of use AMGEN INC. (US) 2005-04-19 US claimed
US-20030139416-A1 Substituted triazinyl acrylamide derivatives and methods of use AMGEN INC. 2003-07-24 US claimed
US-6881737-B2 Substituted triazinyl acrylamide derivatives and methods of use AMGEN INC. (US) 2005-04-19 US disclosed
US-20030139416-A1 Substituted triazinyl acrylamide derivatives and methods of use AMGEN INC. 2003-07-24 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 (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-20030139416-A1 Substituted triazinyl acrylamide derivatives and methods of use PKD1, PKD2, GLS BTK 204/4885EGFR 228/4885JAK3 2043/4885

“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.