SCHEMBL5502234

SCHEMBL5502234

CNc1ncc2cc(-c3cc(NC(=O)c4cc(C(F)(F)F)cc(C(F)(F)F)c4)ccc3C)cnc2n1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LCK P06239 10/20 0.67
KDR P35968 9/20 0.67
JAK3 P52333 8/20 0.67
MAPK14 Q16539 8/20 0.67
BRAF P15056 8/20 0.59
TEK Q02763 3/20 0.59
DDR2 Q16832 1/20 0.51
RAF1 P04049 7/20 0.50
ABL1 P00519 1/20 0.50
KRAS P01116 1/20 0.47
SYK P43405 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
SCHEMBL5498319 0.95 LCK (0.63) LCKKDRJAK3MAPK14BRAF
SCHEMBL5488786 0.93 LCK (0.65) LCKKDRJAK3MAPK14BRAF
SCHEMBL5489142 0.92 LCK (0.79) LCKKDRJAK3MAPK14BRAF
SCHEMBL5498136 0.89 LCK (0.64) LCKKDRJAK3MAPK14BRAF
SCHEMBL30439800 0.88 LCK (0.61) LCKKDRJAK3MAPK14BRAF
SCHEMBL22612763 0.88 LCK (0.61) LCKKDRJAK3MAPK14BRAF
SCHEMBL5493948 0.87 LCK (0.78) LCKKDRJAK3MAPK14BRAF
SCHEMBL5498444 0.87 KDR (0.56) LCKKDRJAK3MAPK14BRAF
SCHEMBL5502399 0.85 LCK (0.58) LCKKDRJAK3MAPK14BRAF
SCHEMBL5494795 0.85 LCK (0.59) LCKKDRJAK3MAPK14BRAF

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
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
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 1044/4885JAK3 60/4885

“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.