SCHEMBL5501072

SCHEMBL5501072

Cc1ccc(NC(=O)c2ccc(C(F)(F)F)cc2F)cc1-c1ccc2nc(N)ncc2c1

nearest known ligand 0.74

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LCK P06239 15/20 0.74
KDR P35968 9/20 0.74
JAK3 P52333 8/20 0.74
MAPK14 Q16539 8/20 0.74
TEK Q02763 4/20 0.74
BRAF P15056 3/20 0.54
DDR2 Q16832 2/20 0.51
EIF2AK3 Q9NZJ5 1/20 0.48
EIF2AK4 Q9P2K8 1/20 0.48
TNKS O95271 1/20 0.48
TNKS2 Q9H2K2 1/20 0.48

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
SCHEMBL5499042 0.93 LCK (0.74) LCKKDRJAK3MAPK14TEK
SCHEMBL5498732 0.91 LCK (0.74) LCKKDRJAK3MAPK14TEK
SCHEMBL5501211 0.90 LCK (0.74) LCKKDRJAK3MAPK14TEK
SCHEMBL5495471 0.86 LCK (0.66) LCKKDRJAK3MAPK14TEK
SCHEMBL5500876 0.85 LCK (0.85) LCKKDRJAK3MAPK14TEK
SCHEMBL5497319 0.85 LCK (0.65) LCKKDRJAK3MAPK14TEK
SCHEMBL5498045 0.85 LCK (0.70) LCKKDRJAK3MAPK14TEK
SCHEMBL5495866 0.85 LCK (1.00) LCKKDRJAK3MAPK14TEK
SCHEMBL5497472 0.85 LCK (1.00) LCKKDRJAK3MAPK14TEK
SCHEMBL5498105 0.84 LCK (0.79) LCKKDRJAK3MAPK14TEK

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.