SCHEMBL6482191

SCHEMBL6482191

C=CC(=O)N1CCc2ccc(Nc3ncnc(Nc4cccc(Cl)c4)n3)cc21

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BTK Q06187 4/20 0.68
EGFR P00533 11/20 0.57
ITK Q08881 3/20 0.57
PIK3CD O00329 1/20 0.51
CCNK O75909 1/20 0.47
CDK12 Q9NYV4 1/20 0.47
SRC P12931 1/20 0.46
BLK P51451 1/20 0.46
SCN9A Q15858 3/20 0.45
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
MAPKAPK2 P49137 1/20 0.42
MAOB P27338 1/20 0.41
GRM5 P41594 1/20 0.41

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
SCHEMBL6493576 0.92 BTK (0.58) BTKEGFRITKPIK3CDCCNK
SCHEMBL28890182 0.81 BTK (1.00) BTKEGFRITKPIK3CDCCNK
SCHEMBL6482094 0.79 BTK (0.58) BTKEGFRITKPIK3CD
SCHEMBL6482187 0.78 SCN9A (0.43) BTKEGFRITKSCN9AMAOB
SCHEMBL6482375 0.74 EGFR (0.46) BTKEGFRITKSRCBLK
SCHEMBL6482618 0.74 EGFR (0.47) BTKEGFRITKSRCBLK
SCHEMBL6483156 0.74 EGFR (0.64) BTKEGFRITKSRCBLK
SCHEMBL30423187 0.73 BTK (0.52) BTKEGFRITKPIK3CDSCN9A
SCHEMBL12518612 0.73 EGFR (1.00) BTKEGFRITK
SCHEMBL29722415 0.73 EGFR (1.00) BTKEGFRITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 228/4885ITK 755/4885

“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.