SCHEMBL5498079

SCHEMBL5498079

Cc1ccc(Nc2nc3cc(C(F)(F)F)ccc3[nH]2)cc1-c1ccc2nc(Nc3ccc(N4CCN(C)CC4)cc3)ncc2c1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 6/20 0.65
LCK P06239 5/20 0.65
MAPK14 Q16539 5/20 0.65
DDR2 Q16832 4/20 0.49
CTSC P53634 2/20 0.48
EGFR P00533 5/20 0.47
STK17A Q9UEE5 1/20 0.46
MAP4K1 Q92918 1/20 0.46
DGAT1 O75907 1/20 0.45
SOAT1 P35610 1/20 0.45
KCNH2 Q12809 1/20 0.45
JAK3 P52333 4/20 0.44
SRC P12931 1/20 0.44
TYK2 P29597 1/20 0.44
SYK P43405 1/20 0.44
BTK Q06187 1/20 0.44
MAPKAPK2 P49137 1/20 0.43

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 0.88 EGFR (0.55) KDRLCKMAPK14EGFRSTK17A
SCHEMBL5491692 0.84 LCK (0.88) KDRLCKMAPK14DDR2JAK3
SCHEMBL5492853 0.82 KDR (0.67) KDRLCKMAPK14EGFRSTK17A
SCHEMBL5494435 0.78 MAP4K1 (0.57) EGFRSTK17AMAP4K1SYK
SCHEMBL5497607 0.77 LCK (0.61) KDRLCKMAPK14DDR2STK17A
SCHEMBL5497043 0.76 LCK (0.67) KDRLCKMAPK14DDR2EGFR
SCHEMBL5502952 0.74 LCK (0.71) KDRLCKMAPK14DDR2JAK3
SCHEMBL5498684 0.74 LCK (0.62) KDRLCKMAPK14DDR2JAK3
SCHEMBL5494938 0.73 DDR2 (0.54) KDRLCKMAPK14DDR2STK17A
SCHEMBL5501445 0.72 MAP4K1 (0.64) EGFRSTK17AMAP4K1KCNH2JAK3

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.