SCHEMBL6497404

SCHEMBL6497404

C=CC(=O)Nc1cccc(Nc2ncnc(N(C)c3ccc(OCc4ccccc4)cc3)n2)c1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTK Q06187 13/20 0.57
EGFR P00533 12/20 0.53
ERBB2 P04626 1/20 0.53
JAK3 P52333 2/20 0.49
ITK Q08881 3/20 0.47
JAK2 O60674 1/20 0.47
LYN P07948 1/20 0.47
TEC P42680 1/20 0.47
TXK P42681 1/20 0.47
BMX P51813 1/20 0.47
CD69 Q07108 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
SCHEMBL6492558 0.88 EGFR (0.51) BTKEGFRERBB2JAK3ITK
SCHEMBL6484825 0.86 EGFR (0.66) BTKEGFRERBB2JAK3ITK
SCHEMBL6497399 0.83 BTK (0.58) BTKEGFRERBB2JAK3ITK
SCHEMBL6496347 0.81 ERBB2 (0.55) BTKEGFRERBB2JAK3ITK
SCHEMBL6483473 0.80 ERBB2 (0.55) BTKEGFRERBB2JAK3ITK
SCHEMBL6482768 0.79 EGFR (0.55) BTKEGFRJAK3ITK
SCHEMBL6482330 0.76 EGFR (0.62) BTKEGFRERBB2JAK3ITK
SCHEMBL30423295 0.75 EGFR (0.75) BTKEGFRERBB2JAK3ITK
SCHEMBL28400978 0.75 EGFR (0.75) BTKEGFRERBB2JAK3ITK
SCHEMBL24556073 0.74 BTK (0.49) BTKEGFRERBB2JAK3

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 228/4885ERBB2 440/4885

“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.