SCHEMBL3384274

SCHEMBL3384274

c1ccc(-c2cc(-c3c[nH]c4ncccc34)c3cccnc3n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 8/20 0.56
DBF4 Q9UBU7 2/20 0.56
CDK1 P06493 3/20 0.54
CCNB2 O95067 2/20 0.54
CCNB1 P14635 2/20 0.54
CCNB3 Q8WWL7 2/20 0.54
PIM1 P11309 5/20 0.52
PRKACA P17612 5/20 0.52
GSK3B P49841 5/20 0.52
MAP4K4 O95819 4/20 0.52
CLK4 Q9HAZ1 4/20 0.52
CDK2 P24941 4/20 0.52
HIPK2 Q9H2X6 4/20 0.52
ROCK2 O75116 3/20 0.52
IRAK4 Q9NWZ3 2/20 0.52
CDK9 P50750 5/20 0.49
CDK5 Q00535 5/20 0.49
PDPK1 O15530 2/20 0.49
CCNT1 O60563 1/20 0.49
CCNA2 P20248 1/20 0.49

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
SCHEMBL12501031 0.88 CCNB2 (0.51) CDC7DBF4CDK1CCNB2CCNB1
SCHEMBL3382045 0.85 TOP1 (0.48) CDC7DBF4CDK1CCNB2CCNB1
SCHEMBL3386630 0.84 CDC7 (0.52) CDC7DBF4CDK1CCNB2CCNB1
SCHEMBL18020157 0.81 TOP1 (0.56) MAPK1MKNK2
SCHEMBL1604437 0.80 CDC7 (0.70) CDC7DBF4CDK1CCNB2CCNB1
SCHEMBL3740263 0.79 CAMKK2 (0.69) CDC7DBF4CDK1CCNB2CCNB1
SCHEMBL20846288 0.78 CAMKK2 (0.60) CDC7DBF4CDK1CCNB2CCNB1
SCHEMBL3384861 0.78 BRD4 (0.58) CDC7CDK1CCNB2CCNB1CCNB3
SCHEMBL12501067 0.77 BRD4 (0.54) CDC7CDK1CCNB2CCNB1CCNB3
SCHEMBL5618155 0.77 TGFBR1 (0.71) CDC7PIM1PRKACAGSK3BMAP4K4

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 13 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-9725446-B2 7-azaindole derivatives MERCK PATENT GMBH (DE) 2017-08-08 US disclosed
US-9725446-B2 7-azaindole derivatives MERCK PATENT GMBH (DE) 2017-08-08 US disclosed
US-20160130269-A1 7-AZAINDOLE DERIVATIVES MERCK PATENT GMBH (DE) 2016-05-12 US disclosed
US-20160130269-A1 7-AZAINDOLE DERIVATIVES MERCK PATENT GMBH (DE) 2016-05-12 US disclosed
US-20150152104-A1 7-AZAINDOLE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-04 US disclosed
US-20150152104-A1 7-AZAINDOLE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-04 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-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 (3 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-20150152104-A1 7-AZAINDOLE DERIVATIVES PDK1, PDK2, PDK3 CDC7 70/4885DBF4 4234/4885CDK1 15/4885
US-20130102603-A1 2,4-DIARYL - SUBSTITUTED [1,8] NAPHTHYRIDINES AS KINASE INHIBITORS FOR USE AGAINST CANCER TGFBR1, TAB1, TGFBR2 CDC7 115/4885DBF4 1556/4885CDK1 54/4885
US-20160130269-A1 7-AZAINDOLE DERIVATIVES PDK1, PDK2, PDK3 CDC7 63/4885DBF4 4173/4885CDK1 14/4885

“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.