SCHEMBL5492853

SCHEMBL5492853

CNc1ncc2cc(-c3cc(Nc4nc5ccc(N6CCN(C)CC6)cc5[nH]4)ccc3C)ccc2n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.67
LCK P06239 8/20 0.67
MAPK14 Q16539 8/20 0.67
KCNH2 Q12809 2/20 0.53
EGFR P00533 2/20 0.44
STK17A Q9UEE5 1/20 0.44
JAK3 P52333 6/20 0.43
MAP4K1 Q92918 1/20 0.43
SRC P12931 1/20 0.41
TYK2 P29597 1/20 0.41
SYK P43405 1/20 0.41
BTK Q06187 1/20 0.41
TOP1 P11387 2/20 0.41
TOP2A P11388 2/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 1/20 0.40
SLCO2B1 O94956 1/20 0.40

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
SCHEMBL5501586 0.87 EGFR (0.55) KDRLCKMAPK14KCNH2EGFR
SCHEMBL5493530 0.82 LCK (0.75) KDRLCKMAPK14JAK3SMN1; SMN2
SCHEMBL5498079 0.82 KDR (0.65) KDRLCKMAPK14KCNH2EGFR
SCHEMBL5489837 0.81 LCK (0.76) KDRLCKMAPK14JAK3SRC
SCHEMBL5503944 0.77 LCK (0.67) KDRLCKMAPK14JAK3
SCHEMBL5491692 0.76 LCK (0.88) KDRLCKMAPK14JAK3SRC
SCHEMBL5494435 0.76 MAP4K1 (0.57) EGFRSTK17AMAP4K1SYK
SCHEMBL5497607 0.75 LCK (0.61) KDRLCKMAPK14STK17AJAK3
SCHEMBL14593541 0.74 LCK (0.61) KDRLCKMAPK14JAK3
SCHEMBL5496586 0.72 LCK (0.74) KDRLCKMAPK14JAK3SRC

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 KDR 1044/4885LCK 106/4885MAPK14 301/4885

“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.