SCHEMBL8656291

SCHEMBL8656291

FC(F)(F)COc1ccccc1Sc1nc[nH]n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34
SLC6A9 P48067 3/20 0.33
KDM2B Q8NHM5 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
UGCG Q16739 1/20 0.33
SMPD3 Q9NY59 1/20 0.33
MRGPRX1 Q96LB2 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
S1PR2 O95136 1/20 0.33
S1PR4 O95977 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
XBP1 P17861 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
SCHEMBL943074 0.74 MAPT (0.42) ALOX5APFEN1MRGPRX1SLC6A2SLC6A4
SCHEMBL27951613 0.72 AR (0.43) ALOX5APFEN1SLC6A2SLC6A4MEN1
SCHEMBL28288419 0.70 MAPT (0.52) ALOX5APFEN1SLC6A2SLC6A4MEN1
SCHEMBL29635641 0.67 L3MBTL1 (0.48) ALOX5APFEN1MEN1MAPTKMT2A
SCHEMBL10499330 0.67 L3MBTL1 (0.48) ALOX5APFEN1MEN1MAPTKMT2A
SCHEMBL9376880 0.67 PDE2A (0.39) MAPTNPSR1ALDH1A1
SCHEMBL3804136 0.66
SCHEMBL2357267 0.66 GAA (0.57) MEN1MAPTKMT2AS1PR2S1PR4
SCHEMBL9171200 0.66 CXCL12 (0.37) MAPTLMNAHTTSMN1; SMN2KDM4E
SCHEMBL3655004 0.66 MAPT (0.44) ALOX5APFEN1MRGPRX1SLC6A2SLC6A4

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-0541809-B1 TRIAZOLE COMPOUND CHUGAI PHARMACEUTICAL CO LTD (JP) 1998-11-04 EP disclosed
US-5338720-A Low dosage CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1994-08-16 US disclosed
EP-0541809-A1 TRIAZOLE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1993-05-19 EP disclosed