SCHEMBL5495548

SCHEMBL5495548

CN(C)[C@H]1CCCN(c2ccc(C(F)(F)F)cc2NC(=O)c2cc(-c3ccc4nc(N)ncc4c3)ccc2F)C1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LCK P06239 17/20 0.72
TEK Q02763 14/20 0.72
KDR P35968 12/20 0.72
JAK3 P52333 2/20 0.72
JAK2 O60674 1/20 0.72
NTRK1 P04629 1/20 0.72
INSR P06213 1/20 0.72
FES P07332 1/20 0.72
LYN P07948 1/20 0.72
FGR P09769 1/20 0.72
KIT P10721 1/20 0.72
JAK1 P23458 1/20 0.72
CSK P41240 1/20 0.72
EPHB4 P54760 1/20 0.72
MAPK14 Q16539 1/20 0.47
TNKS O95271 1/20 0.44
TNKS2 Q9H2K2 1/20 0.44

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
SCHEMBL5496131 0.96 LCK (0.71) LCKTEKKDRJAK3JAK2
SCHEMBL13220187 0.91 TEK (0.80) LCKTEKKDRJAK3JAK2
SCHEMBL13219938 0.91 TEK (0.80) LCKTEKKDRJAK3JAK2
SCHEMBL13220026 0.89 TEK (0.72) LCKTEKKDRJAK3JAK2
SCHEMBL5496870 0.88 LCK (0.68) LCKTEKKDRJAK3JAK2
SCHEMBL14568238 0.87 LCK (0.61) LCKTEKKDRJAK3JAK2
SCHEMBL5498521 0.87 LCK (0.61) LCKTEKKDRJAK3JAK2
SCHEMBL13219946 0.87 KDR (0.79) LCKTEKKDRJAK3JAK2
SCHEMBL13219739 0.87 KDR (0.79) LCKTEKKDRJAK3JAK2
SCHEMBL5496630 0.85 LCK (0.67) LCKTEKKDRJAK3JAK2

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 8 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
EP-1836174-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC. (US) 2007-09-26 EP claimed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 US claimed
WO-2006039718-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2006-04-13 WO claimed
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
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 106/4885TEK 836/4885KDR 1044/4885

“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.