SCHEMBL2419161

SCHEMBL2419161

COc1cccc(NC(=O)c2cc3c(NC(=O)Cc4ccc(Cl)cc4)n[nH]c3s2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.53
CRHBP P24387 1/20 0.53
CRHR2 Q13324 1/20 0.53
MAPT P10636 1/20 0.52
POLB P06746 1/20 0.48
USP2 O75604 1/20 0.48
TP53 P04637 2/20 0.46
HTT P42858 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
CSNK1D P48730 1/20 0.45
PDGFRB P09619 1/20 0.44
FLT4 P35916 1/20 0.44
FLT3 P36888 1/20 0.43
KDR P35968 1/20 0.43
DRD2 P14416 1/20 0.43
DRD4 P21917 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL2417035 0.94 USP2 (0.51) L3MBTL1POLBUSP2TP53HTT
SCHEMBL2417376 0.92 USP2 (0.49) L3MBTL1CRHBPCRHR2MAPTPOLB
SCHEMBL2416383 0.92 USP2 (0.49) L3MBTL1CRHBPCRHR2MAPTPOLB
SCHEMBL2413176 0.92 USP2 (0.59) L3MBTL1MAPTPOLBUSP2TP53
SCHEMBL2417977 0.91 TP53 (0.56) L3MBTL1MAPTTP53KMT2AMEN1
SCHEMBL2418326 0.91 USP2 (0.48) L3MBTL1CRHBPCRHR2MAPTPOLB
SCHEMBL2416650 0.89 MAPT (0.48) L3MBTL1MAPTPOLBTP53KMT2A
SCHEMBL2416783 0.89 TP53 (0.51) MAPTPOLBTP53KMT2AMEN1
SCHEMBL2413237 0.87 TP53 (0.55) L3MBTL1CRHBPCRHR2MAPTTP53
SCHEMBL2415170 0.87 NLRP3 (0.44) MAPTPOLBTP53KMT2AMEN1

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 9 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

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 L3MBTL1 3407/4885CRHBP 3156/4885CRHR2 3959/4885
US-20060122249-A1 Condensed heterocyclic pyrazole derivatives as kinase inhibitors CDK2, MAP3K19, MAP3K15 L3MBTL1 3407/4885CRHBP 3156/4885CRHR2 3959/4885

“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.