SCHEMBL3386702

SCHEMBL3386702

Cc1cc(F)ccc1-c1cc(-c2c[nH]c3ncccc23)c2cccnc2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.51
CDC7 O00311 3/20 0.51
MAP4K4 O95819 2/20 0.51
PIM1 P11309 2/20 0.51
PRKACA P17612 2/20 0.51
CLK4 Q9HAZ1 2/20 0.51
CDK2 P24941 2/20 0.51
ROCK2 O75116 1/20 0.51
HIPK2 Q9H2X6 1/20 0.51
IRAK4 Q9NWZ3 1/20 0.51
DYRK1A Q13627 4/20 0.46
CDK1 P06493 7/20 0.46
CCNB1 P14635 7/20 0.46
CCNB2 O95067 6/20 0.46
CCNB3 Q8WWL7 6/20 0.46
RET P07949 4/20 0.46
PDPK1 O15530 5/20 0.45
CDK9 P50750 2/20 0.45
CDK5 Q00535 2/20 0.45
DAPK3 O43293 1/20 0.45

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
SCHEMBL3386631 0.79 CDC7 (0.47) GSK3BCDC7MAP4K4PIM1PRKACA
SCHEMBL3384274 0.77 CDC7 (0.56) GSK3BCDC7MAP4K4PIM1PRKACA
SCHEMBL857353 0.76 CDC7 (0.65) GSK3BCDC7MAP4K4PIM1PRKACA
SCHEMBL3384861 0.76 BRD4 (0.58) GSK3BCDC7MAP4K4PIM1PRKACA
SCHEMBL14877206 0.76 CDC7 (0.46) GSK3BCDC7MAP4K4PIM1PRKACA
SCHEMBL3382045 0.74 TOP1 (0.48) GSK3BCDC7MAP4K4PIM1PRKACA
SCHEMBL12501067 0.73 BRD4 (0.54) GSK3BCDC7MAP4K4PIM1PRKACA
SCHEMBL12501091 0.73 CDC7 (0.46) GSK3BCDC7MAP4K4PIM1PRKACA
SCHEMBL3386630 0.73 CDC7 (0.52) GSK3BCDC7MAP4K4PIM1PRKACA
SCHEMBL3380438 0.71 CCNB2 (0.47) GSK3BCDC7MAP4K4PIM1PRKACA

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 GSK3B 164/4885CDC7 115/4885MAP4K4 36/4885

“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.