SCHEMBL5504491

SCHEMBL5504491

CC1(C)OB(c2ccc3nc(NCCN4CCOCC4)ncc3c2)OC1(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 4/20 0.49
KDR P35968 4/20 0.49
MAPK14 Q16539 4/20 0.49
MAPK9 P45984 2/20 0.49
MAPK10 P53779 2/20 0.49
KIT P10721 1/20 0.49
RIPK1 Q13546 1/20 0.48
RIPK3 Q9Y572 1/20 0.48
JAK3 P52333 3/20 0.45
MKNK1 Q9BUB5 2/20 0.45
EGFR P00533 2/20 0.44
MAPK8 P45983 2/20 0.43
SRC P12931 2/20 0.43
TYK2 P29597 1/20 0.43
SYK P43405 1/20 0.43
BTK Q06187 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
RAB9A P51151 1/20 0.40
TSHR P16473 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
SCHEMBL21416877 0.81 LCK (0.58) LCKKDRMAPK14MAPK9MAPK10
SCHEMBL14724662 0.79 LCK (0.53) LCKKDRMAPK14MAPK9MAPK10
SCHEMBL700222 0.79 KDR (0.45) KDREGFRSYKMEN1KMT2A
SCHEMBL5488941 0.79 EGFR (0.56) LCKKDRMAPK14MAPK9MAPK10
SCHEMBL31460645 0.76 MAPK1 (0.44) LCKMAPK14MAPK9MAPK10MAPK8
SCHEMBL171459 0.76 GAA (0.44) EGFRMEN1KMT2ARAB9ATSHR
SCHEMBL1368949 0.75 EGFR (0.39) LCKEGFR
SCHEMBL29545777 0.75 EGFR (0.39) LCKEGFR
SCHEMBL12517474 0.75 ACHE (0.43) SRCMEN1KMT2ARAB9AFGFR1
SCHEMBL5489289 0.75 RIPK1 (0.61) LCKKDRMAPK14MAPK9MAPK10

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 3 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 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

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 106/4885KDR 1044/4885MAPK14 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.