SCHEMBL5501586

SCHEMBL5501586

Cc1ccc(Nc2nc3ccccc3[nH]2)cc1-c1ccc2nc(Nc3ccc(N4CCN(C)CC4)cc3)ncc2c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.55
LCK P06239 1/20 0.55
KDR P35968 1/20 0.55
MAPK14 Q16539 1/20 0.55
MAP4K1 Q92918 1/20 0.54
STK17A Q9UEE5 1/20 0.50
JAK3 P52333 1/20 0.46
KCNH2 Q12809 2/20 0.45
CCNK O75909 1/20 0.45
CCNA2 P20248 1/20 0.45
CDK2 P24941 1/20 0.45
CCND3 P30281 1/20 0.45
CDK9 P50750 1/20 0.45
CDK6 Q00534 1/20 0.45
BRD4 O60885 7/20 0.44
ALK Q9UM73 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
SCHEMBL5498079 0.88 KDR (0.65) EGFRLCKKDRMAPK14MAP4K1
SCHEMBL5492853 0.87 KDR (0.67) EGFRLCKKDRMAPK14MAP4K1
SCHEMBL5493530 0.83 LCK (0.75) LCKKDRMAPK14JAK3
SCHEMBL5494435 0.81 MAP4K1 (0.57) EGFRMAP4K1STK17ABRD4ALK
SCHEMBL5497607 0.80 LCK (0.61) LCKKDRMAPK14MAP4K1STK17A
SCHEMBL5501445 0.77 MAP4K1 (0.64) EGFRMAP4K1STK17AJAK3KCNH2
SCHEMBL5488920 0.77 LCK (0.56) LCKKDRMAPK14MAP4K1JAK3
SCHEMBL5494938 0.77 DDR2 (0.54) LCKKDRMAPK14MAP4K1STK17A
SCHEMBL2968000 0.76 EGFR (0.61) EGFRKDRMAPK14MAP4K1JAK3
SCHEMBL5497043 0.75 LCK (0.67) EGFRLCKKDRMAPK14JAK3

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 EGFR 333/4885LCK 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.