SCHEMBL2416993

SCHEMBL2416993

O=C(Cc1cccc(Cl)c1)Nc1n[nH]c2sc(C(=O)NCc3ccc(Cl)cc3)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.51
KDR P35968 3/20 0.51
DYRK1A Q13627 3/20 0.51
PLK4 O00444 2/20 0.51
AURKA O14965 2/20 0.51
PRKD3 O94806 2/20 0.51
MAP4K4 O95819 2/20 0.51
CHEK2 O96017 2/20 0.51
RPS6KB1 P23443 2/20 0.51
FLT4 P35916 2/20 0.51
CLK2 P49760 2/20 0.51
PRKX P51817 2/20 0.51
CSNK1G2 P78368 2/20 0.51
BRSK1 Q8TDC3 2/20 0.51
AURKB Q96GD4 2/20 0.51
SLK Q9H2G2 2/20 0.51
CLK4 Q9HAZ1 2/20 0.51
SGK2 Q9HBY8 2/20 0.51
PDPK1 O15530 1/20 0.51
DYRK3 O43781 1/20 0.51

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
SCHEMBL2417443 0.95 KDR (0.49) MAPK1KDRDYRK1APLK4AURKA
SCHEMBL2414027 0.95 MAPT (0.47) MAPK1KDRDYRK1APLK4AURKA
SCHEMBL2422393 0.94 MAPT (0.49) MAPK1KDRDYRK1APLK4AURKA
SCHEMBL2409755 0.94 KDR (0.44) MAPK1KDRDYRK1APLK4AURKA
SCHEMBL2419531 0.92 KDR (0.49) MAPK1KDRDYRK1APLK4AURKA
SCHEMBL2418866 0.92 MAPK1 (0.49) MAPK1KDRDYRK1APLK4AURKA
SCHEMBL2412280 0.91 KDR (0.51) MAPK1KDRDYRK1APLK4AURKA
SCHEMBL2414657 0.90 MAPT (0.51) MAPK1KDRDYRK1APLK4AURKA
SCHEMBL2417462 0.90 MAPT (0.46) MAPK1KDRDYRK1APLK4AURKA
SCHEMBL2416287 0.90 MAPT (0.46) MAPK1KDRDYRK1APLK4AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541378-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2009-06-02 US claimed
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 EP claimed
US-8017643-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-09-13 US disclosed
US-20100286223-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors PFIZER ITALIA S.R.L. (IT) 2010-11-11 US disclosed
US-7786048-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2010-08-31 US disclosed
US-20090233813-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors PFIZER ITALIA S.R.L. (IT) 2009-09-17 US disclosed
US-7541378-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2009-06-02 US disclosed
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 EP disclosed
US-20060122249-A1 Condensed heterocyclic pyrazole derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2006-06-08 US disclosed
EP-1530573-A1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2005-05-18 EP disclosed
WO-2004013146-A1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A (IT) 2004-02-12 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 (2 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-20100286223-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors CDK2, MAP3K19, MAP3K15 MAPK1 138/4885KDR 1181/4885DYRK1A 698/4885
US-20060122249-A1 Condensed heterocyclic pyrazole derivatives as kinase inhibitors CDK2, MAP3K19, MAP3K15 MAPK1 138/4885KDR 1181/4885DYRK1A 698/4885

“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.