SCHEMBL5498965

SCHEMBL5498965

CNc1ncc2cc(-c3cccc(NC(=O)c4cc(F)cc(C(F)(F)F)c4)c3C)cnc2n1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LCK P06239 12/20 0.50
KDR P35968 9/20 0.50
MAPK14 Q16539 9/20 0.50
JAK3 P52333 6/20 0.50
BRAF P15056 2/20 0.45
TEK Q02763 1/20 0.45
PIK3CA P42336 3/20 0.44
KRAS P01116 1/20 0.44
RAF1 P04049 1/20 0.44
BMX P51813 1/20 0.41
CSF1R P07333 1/20 0.41
TP53 P04637 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
SCHEMBL5501266 0.95 LCK (0.53) LCKKDRMAPK14JAK3BRAF
SCHEMBL5496609 0.91 LCK (0.59) LCKKDRMAPK14JAK3BRAF
SCHEMBL14568118 0.89 LCK (0.49) LCKKDRMAPK14JAK3TEK
SCHEMBL5493088 0.88 LCK (0.65) LCKKDRMAPK14JAK3BRAF
SCHEMBL5498297 0.85 LCK (0.51) LCKKDRMAPK14JAK3BRAF
SCHEMBL5498319 0.84 LCK (0.63) LCKKDRMAPK14JAK3BRAF
SCHEMBL5494421 0.80 LCK (0.58) LCKKDRMAPK14JAK3BRAF
SCHEMBL5502234 0.79 LCK (0.67) LCKKDRMAPK14JAK3BRAF
SCHEMBL5495633 0.79 LCK (0.64) LCKKDRMAPK14JAK3BRAF
SCHEMBL5498719 0.79 LCK (0.79) LCKKDRMAPK14JAK3BRAF

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836174-B2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2019-10-02 EP claimed
EP-1836174-B1 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2013-02-27 EP claimed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 US claimed
EP-1836174-B2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2019-10-02 EP disclosed
EP-1836174-B1 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2013-02-27 EP disclosed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 US disclosed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 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-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use MAP3K1, MAP3K5, MAP3K2 LCK 106/4885KDR 1044/4885MAPK14 301/4885

“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.