SCHEMBL3382263

SCHEMBL3382263

Cc1ccn(-c2cc(-c3c[nH]c4cnccc34)c3cccnc3n2)n1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IKBKE Q14164 3/20 0.50
PDPK1 O15530 2/20 0.50
TGFBR1 P36897 2/20 0.50
DYRK1A Q13627 11/20 0.45
NFATC1 O95644 6/20 0.45
CDK2 P24941 3/20 0.42
DYRK1B Q9Y463 3/20 0.42
GSK3B P49841 4/20 0.41
IGF1R P08069 2/20 0.38
TBK1 Q9UHD2 2/20 0.38
PIM1 P11309 2/20 0.36
PIM3 Q86V86 2/20 0.36
PIM2 Q9P1W9 2/20 0.36
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.35

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
SCHEMBL2328238 0.74 NPC1 (0.37) IGF1RIDO1
SCHEMBL3386469 0.73 IKBKE (0.52) IKBKEPDPK1TGFBR1DYRK1ANFATC1
SCHEMBL14876913 0.73 IKBKE (0.71) IKBKEPDPK1TGFBR1DYRK1ANFATC1
SCHEMBL12424756 0.72 TGFBR1 (0.41) TGFBR1IGF1RIDO1
SCHEMBL3405607 0.72 L3MBTL1 (0.46) IGF1RIDO1
SCHEMBL10193135 0.71 MAPT (0.45) IGF1RIDO1
SCHEMBL3379371 0.71 IKBKE (0.54) IKBKEPDPK1TGFBR1DYRK1ANFATC1
SCHEMBL3378612 0.69 TGFBR1 (0.52) IKBKEPDPK1TGFBR1DYRK1ANFATC1
SCHEMBL12501045 0.69 TGFBR1 (1.00) IKBKEPDPK1TGFBR1DYRK1ANFATC1
SCHEMBL13834642 0.67 CHEK1 (0.42)

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2585461-B1 2,4-DIARYL-SUBSTITUTED [1,8]NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
EP-2585461-B1 2,4-DIARYL-SUBSTITUTED [1,8]NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
US-8791113-B2 2,4-diaryl-substituted [1,8] naphthyridines as kinase inhibitors for use against cancer MERCK PATENT GMBH (DE) 2014-07-29 US disclosed
US-8791113-B2 2,4-diaryl-substituted [1,8] naphthyridines as kinase inhibitors for use against cancer MERCK PATENT GMBH (DE) 2014-07-29 US disclosed
US-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-25 US disclosed
US-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-04-25 US disclosed
WO-2012000595-A1 2,4- DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER MERCK PATENT GMBH (DE) 2012-01-05 WO 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-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER TGFBR1, TAB1, TGFBR2 IKBKE 52/4885PDPK1 42/4885TGFBR1 1/4885

“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.