SCHEMBL7018716

SCHEMBL7018716

Cc1csc2nc(S)n(C)c(=O)c12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 2/20 0.41
FEN1 P39748 2/20 0.41
ELANE P08246 1/20 0.39
EGLN1 Q9GZT9 1/20 0.35
TGM2 P21980 2/20 0.35
CTDSP1 Q9GZU7 1/20 0.35
MAPT P10636 2/20 0.33
GAA P10253 2/20 0.33
DPP4 P27487 1/20 0.33
NPC1 O15118 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
FLT3 P36888 1/20 0.32
HTT P42858 2/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
PRKCI P41743 1/20 0.32

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
SCHEMBL7017261 0.71 MAPK1 (0.49) MAPTGAANPC1RAB9AHTT
SCHEMBL22146281 0.69 ALDH1A1 (0.46) ERCC5FEN1ELANEEGLN1TGM2
SCHEMBL13833647 0.69 LMNA (0.49) ERCC5FEN1ELANEMAPTGAA
SCHEMBL19700242 0.67 MAPT (0.39) TGM2MAPTGAANPC1RECQL
SCHEMBL7011912 0.67 ELANE (0.46) ELANE
SCHEMBL15474256 0.65 ERCC5 (0.72) ERCC5FEN1
SCHEMBL11869898 0.64 MAPT (0.42) CTDSP1MAPTGAARAB9AHTT
SCHEMBL7010620 0.63 SMN1; SMN2 (0.49) ELANEMAPTGAANPC1RAB9A
SCHEMBL16428215 0.63 ELANE (0.42) ERCC5FEN1ELANEEGLN1CTDSP1
SCHEMBL13764544 0.63 ALDH1A1 (0.57) ELANEEGLN1ALDH1A1MAPK1

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-0836602-B1 FUNGICIDAL PYRIMIDINONES DU PONT (US) 2002-01-30 EP claimed
EP-0733633-B1 Heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-05-28 EP disclosed
EP-0733633-A1 Heterocyclic compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-09-25 EP disclosed