SCHEMBL5359372

SCHEMBL5359372

CS(=O)(=O)Nc1cc(-c2cn(-c3ccc4nncn4n3)nc2-c2ccc(F)cc2)ccn1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSS P25774 1/20 0.38
CSNK1D P48730 5/20 0.37
CSNK1E P49674 5/20 0.37
KCNH2 Q12809 2/20 0.37
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
MAPK10 P53779 5/20 0.35
MAPK8 P45983 2/20 0.35
MAPK9 P45984 2/20 0.35
ABL1 P00519 1/20 0.35
TGFBR1 P36897 1/20 0.35
SRC P12931 2/20 0.35
BRAF P15056 2/20 0.35
KDR P35968 2/20 0.35
NR3C2 P08235 1/20 0.34
RIPK3 Q9Y572 1/20 0.34
PIK3CA P42336 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL5354329 0.88 CSNK1D (0.42) CSNK1DCSNK1EKCNH2MAPK13MAPK12
SCHEMBL5356860 0.86 CSNK1D (0.38) CTSSCSNK1DCSNK1EKCNH2MAPK13
SCHEMBL5351806 0.86 MAPK14 (0.47) CSNK1DKCNH2MAPK13MAPK12MAPK11
SCHEMBL5356877 0.86 MAPK14 (0.46) CSNK1DCSNK1EKCNH2MAPK13MAPK12
SCHEMBL5353381 0.86 MAPK14 (0.46) CSNK1DCSNK1EKCNH2MAPK13MAPK12
SCHEMBL5348556 0.85 NR3C2 (0.41) CSNK1DCSNK1EKCNH2MAPK13MAPK12
SCHEMBL13504615 0.84 MAPK10 (0.39) CSNK1DCSNK1EKCNH2MAPK13MAPK12
SCHEMBL5350468 0.83 TGFBR1 (0.41) CSNK1DCSNK1EKCNH2MAPK13MAPK12
SCHEMBL5355710 0.83 MAPK10 (0.37) CSNK1DCSNK1EKCNH2MAPK13MAPK12
SCHEMBL5352164 0.82 MAPK14 (0.49) CSNK1DCSNK1EMAPK14MAPK10MAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1553096-B1 PYRAZOLE COMPOUNDS UBE INDUSTRIES (JP) 2012-10-31 EP claimed
US-7294625-B2 Pyrazole compounds UBE INDUSTRIES, LTD. (JP) 2007-11-13 US claimed
US-20060063934-A1 3-Pyridazonyl- or triazolopyridazinyl- 4-pyridinyl- or pyrimidinyl- pyrazoles, e.g., 4-(2-aminopyridin-4-yl)-3-phenyl-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazole; p38MAP kinase inhibitors, used to treat rheumatoid arthritis UBE INDUSTRIES, LTD. (JP) 2006-03-23 US claimed
EP-1553096-A1 PYRAZOLE COMPOUNDS Ube Industries, Ltd. (JP) 2005-07-13 EP claimed
EP-1553096-B1 PYRAZOLE COMPOUNDS UBE INDUSTRIES (JP) 2012-10-31 EP disclosed
US-7294625-B2 Pyrazole compounds UBE INDUSTRIES, LTD. (JP) 2007-11-13 US disclosed
US-20060063934-A1 3-Pyridazonyl- or triazolopyridazinyl- 4-pyridinyl- or pyrimidinyl- pyrazoles, e.g., 4-(2-aminopyridin-4-yl)-3-phenyl-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazole; p38MAP kinase inhibitors, used to treat rheumatoid arthritis UBE INDUSTRIES, LTD. (JP) 2006-03-23 US disclosed
EP-1553096-A1 PYRAZOLE COMPOUNDS Ube Industries, Ltd. (JP) 2005-07-13 EP 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-20060063934-A1 3-Pyridazonyl- or triazolopyridazinyl- 4-pyridinyl- or pyrimidinyl- pyrazoles, e.g., 4-(2-aminopyridin-4-yl)-3-phenyl-1-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazole; p38MAP kinase inhibitors, used to treat rheumatoid arthritis CNKSR1, MAPK1, MAPK3 CTSS 3999/4885CSNK1D 175/4885CSNK1E 407/4885

“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.