SCHEMBL5502398

SCHEMBL5502398

CNc1ncc2cc(-c3c(C)ccc4c(=O)[nH]c(C)nc34)ccc2n1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LCK P06239 13/20 0.51
BRAF P15056 5/20 0.51
KDR P35968 10/20 0.49
MAPK14 Q16539 10/20 0.49
TEK Q02763 2/20 0.46
EIF2AK3 Q9NZJ5 1/20 0.41
EIF2AK4 Q9P2K8 1/20 0.41
JAK3 P52333 7/20 0.40
PARP1 P09874 4/20 0.40
FGFR4 P22455 1/20 0.36
ACVR1 Q04771 1/20 0.36
KIT P10721 1/20 0.36
SRC P12931 1/20 0.36

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
SCHEMBL2267315 0.80 LCK (0.56) LCKBRAFKDRMAPK14TEK
SCHEMBL2264346 0.74 LCK (0.46) LCKBRAFKDRMAPK14TEK
SCHEMBL5490182 0.74 LCK (0.57) LCKBRAFKDRMAPK14TEK
SCHEMBL2265652 0.73 LCK (0.68) LCKBRAFKDRMAPK14TEK
SCHEMBL4765016 0.73 LCK (0.61) LCKBRAFKDRMAPK14TEK
SCHEMBL2265303 0.73 LCK (0.73) LCKBRAFKDRMAPK14TEK
SCHEMBL23015922 0.72 BRAF (0.60) LCKBRAFKDRMAPK14TEK
SCHEMBL5489350 0.72 LCK (0.55) LCKBRAFKDRMAPK14TEK
SCHEMBL2264242 0.72 LCK (0.52) LCKBRAFKDRMAPK14TEK
SCHEMBL2261990 0.71 LCK (0.55) LCKBRAFKDRMAPK14TEK

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 106/4885BRAF 100/4885KDR 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.