SCHEMBL8327686

SCHEMBL8327686

CSc1c(C#N)c(=N)n(C)c(=S)n1C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 2/20 0.35
GRIA4 P48058 2/20 0.35
EGFR P00533 1/20 0.30
SRC P12931 1/20 0.30

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
SCHEMBL18656052 0.71 LPO (0.32)
SCHEMBL8328828 0.63 AOC3 (0.45) GRIA2GRIA4EGFRSRC
SCHEMBL19486386 0.62
SCHEMBL7922166 0.56 LMNA (0.41) GRIA2GRIA4
SCHEMBL16402408 0.56 GAA (0.39) GRIA2GRIA4
SCHEMBL11320669 0.54 LPO (0.44)
SCHEMBL12507811 0.52 ALDH1A1 (0.36) EGFRSRC
SCHEMBL9564333 0.50 DYRK1A (0.44) GRIA4EGFRSRC
SCHEMBL13390161 0.49 MEN1 (0.52)
SCHEMBL12147468 0.49 ALDH1A1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0760368-B1 PYRIMIDINE DERIVATIVES NISSHIN FLOUR MILLING CO (JP) 1999-07-28 EP disclosed
US-5736550-A TREATMENT OF GASTROINTESTINAL TRACT DISORDERS NISSHIN FLOUR MILLING CO., LTD. (JP) 1998-04-07 US disclosed
EP-0760368-A1 NOVEL PYRIMIDINE DERIVATIVE NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-03-05 EP disclosed