SCHEMBL5498528

SCHEMBL5498528

CCN(CC)CCNC(=O)Nc1ccc(NC(=O)c2ccc(C)c(-c3cnc4nc(NC)ncc4c3)c2)cc1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.57
LCK P06239 14/20 0.57
MAPK14 Q16539 14/20 0.57
JAK3 P52333 13/20 0.57
BRAF P15056 5/20 0.51
RAF1 P04049 3/20 0.51
KRAS P01116 2/20 0.51
TEK Q02763 2/20 0.51
KIT P10721 1/20 0.43
PDGFRA P16234 1/20 0.43
EIF2AK3 Q9NZJ5 1/20 0.43
EIF2AK4 Q9P2K8 1/20 0.43
EGFR P00533 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
SCHEMBL5504532 0.90 KDR (0.50) KDRLCKMAPK14JAK3BRAF
SCHEMBL5504527 0.88 KDR (0.52) KDRLCKMAPK14JAK3BRAF
SCHEMBL5498705 0.85 LCK (0.55) KDRLCKMAPK14JAK3BRAF
SCHEMBL5498405 0.84 KDR (0.68) KDRLCKMAPK14JAK3BRAF
SCHEMBL5488739 0.84 LCK (0.61) KDRLCKMAPK14JAK3BRAF
SCHEMBL5494757 0.81 LCK (0.80) KDRLCKMAPK14JAK3BRAF
SCHEMBL5497062 0.80 LCK (0.63) KDRLCKMAPK14JAK3BRAF
SCHEMBL5498136 0.78 LCK (0.64) KDRLCKMAPK14JAK3BRAF
SCHEMBL5501153 0.78 LCK (0.52) KDRLCKMAPK14JAK3BRAF
SCHEMBL5488786 0.77 LCK (0.65) KDRLCKMAPK14JAK3BRAF

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 KDR 1044/4885LCK 106/4885MAPK14 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.