SCHEMBL2412972

SCHEMBL2412972

Cc1ccc(NC(=O)c2cc3c(NC(=O)c4ccccc4C)n[nH]c3s2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
MAPT P10636 3/20 0.49
THRB P10828 1/20 0.49
HPGD P15428 1/20 0.46
TYK2 P29597 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
NFKB1 P19838 1/20 0.43
HTT P42858 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
HSD17B10 Q99714 1/20 0.43
FLT3 P36888 1/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 2/20 0.43
POLB P06746 2/20 0.43
KDM4E B2RXH2 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
SCHEMBL2416444 0.94 HPGD (0.54) SMN1; SMN2MAPTTHRBHPGDTYK2
SCHEMBL2416186 0.92 MAPT (0.48) SMN1; SMN2MAPTTHRBHPGDTYK2
SCHEMBL2417373 0.92 MEN1 (0.48) SMN1; SMN2MAPTTHRBHPGDTYK2
SCHEMBL2417788 0.90 RAB9A (0.60) SMN1; SMN2MAPTTHRBNPC1RAB9A
SCHEMBL2418058 0.90 BDKRB1 (0.54) HPGDTYK2NPC1RAB9AKMT2A
SCHEMBL2416647 0.90 MEN1 (0.48) SMN1; SMN2MAPTHPGDRXFP1NPC1
SCHEMBL2414062 0.89 LRRK2 (0.46) SMN1; SMN2MAPTTHRBHPGDTYK2
SCHEMBL2417419 0.89 MAPT (0.52) SMN1; SMN2MAPTTHRBRXFP1NPC1
SCHEMBL2417849 0.87 NPC1 (0.54) SMN1; SMN2MAPTRXFP1NPC1RAB9A
SCHEMBL2417780 0.87 MEN1 (0.46) SMN1; SMN2MAPTTHRBHPGDRXFP1

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 SMN1; SMN2 4291/4885MAPT 2293/4885THRB 2599/4885
US-20060122249-A1 Condensed heterocyclic pyrazole derivatives as kinase inhibitors CDK2, MAP3K19, MAP3K15 SMN1; SMN2 4291/4885MAPT 2293/4885THRB 2599/4885

“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.