SCHEMBL5496622

SCHEMBL5496622

CCNC(=O)c1ccc(C)c(-c2ccc3nc(N[C@H]4CCC(=O)NC4)ncc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.52
LCK P06239 12/20 0.52
KDR P35968 12/20 0.52
JAK3 P52333 7/20 0.52
KIT P10721 1/20 0.49
MAPK9 P45984 1/20 0.49
MAPK10 P53779 1/20 0.49
DDR2 Q16832 1/20 0.44
BRAF P15056 3/20 0.44
TEK Q02763 1/20 0.43
RIPK1 Q13546 1/20 0.43
RIPK3 Q9Y572 1/20 0.43
CSF1R P07333 1/20 0.43
ABL1 P00519 1/20 0.42

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
SCHEMBL5489130 0.90 MAPK14 (0.58) MAPK14LCKKDRJAK3KIT
SCHEMBL5498159 0.90 MAPK14 (0.58) MAPK14LCKKDRJAK3KIT
SCHEMBL5497028 0.90 MAPK14 (0.58) MAPK14LCKKDRJAK3KIT
SCHEMBL14724717 0.81 MAPK14 (0.53) MAPK14LCKKDRJAK3KIT
SCHEMBL5490319 0.81 BRAF (0.46) MAPK14LCKKDRJAK3KIT
SCHEMBL5497209 0.77 MAPK14 (0.61) MAPK14LCKKDRJAK3KIT
Bicarbonate SCHEMBL14715594 0.77 MAPK14 (0.66) MAPK14LCKKDRJAK3KIT
SCHEMBL5494682 0.76 MAPK14 (0.59) MAPK14LCKKDRJAK3KIT
SCHEMBL21416867 0.76 MAPK14 (0.59) MAPK14LCKKDRJAK3KIT
SCHEMBL5495649 0.75 MAPK14 (0.62) MAPK14LCKKDRJAK3KIT

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 9 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
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 MAPK14 301/4885LCK 106/4885KDR 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.