SCHEMBL8996597

SCHEMBL8996597

CCCCSc1snc(OC(F)F)c1C#N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.49
MAPT P10636 7/20 0.36
HSD17B10 Q99714 3/20 0.35
MAPK1 P28482 2/20 0.35
TP53 P04637 1/20 0.35
TSHR P16473 1/20 0.35
MEN1 O00255 4/20 0.35
KMT2A Q03164 4/20 0.35
HPGD P15428 3/20 0.35
GAA P10253 2/20 0.34
PKM P14618 2/20 0.34
JAK2 O60674 1/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
HTT P42858 2/20 0.33
KDM4E B2RXH2 1/20 0.33
STAT6 P42226 1/20 0.33
HIF1A Q16665 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.31

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
SCHEMBL9412243 0.86 ALDH1A1 (0.43) ALDH1A1MAPTHSD17B10MAPK1TP53
SCHEMBL9412225 0.85 ALDH1A1 (0.44) ALDH1A1MAPTHSD17B10MAPK1TP53
SCHEMBL9412204 0.82 ALDH1A1 (0.39) ALDH1A1MAPTHSD17B10MAPK1TP53
SCHEMBL8996607 0.79 ALDH1A1 (0.40) ALDH1A1MAPTHSD17B10MAPK1TP53
SCHEMBL9412274 0.78 MAPT (0.58) ALDH1A1MAPTHSD17B10MAPK1TP53
SCHEMBL9412186 0.78 ALDH1A1 (0.45) ALDH1A1MAPTHSD17B10MAPK1TP53
SCHEMBL9412213 0.77 ALDH1A1 (0.61) ALDH1A1MAPTHSD17B10MAPK1TP53
SCHEMBL8996591 0.77 ALDH1A1 (0.35) ALDH1A1MAPTHSD17B10MAPK1TP53
SCHEMBL9412224 0.76 FNTA (0.33) ALDH1A1MAPTHSD17B10MAPK1TP53
SCHEMBL9412223 0.75 ALDH1A1 (0.36) ALDH1A1MAPTHSD17B10MAPK1TP53

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
US-5484934-A FUNGICIDE, WOOD PRESERVATIVE NIHON NOHYAKU CO., LTD. (JP) 1996-01-16 US disclosed
EP-0604978-A1 Isothiazole derivatives, a process for production thereof and uses thereof NIHON NOHYAKU CO., LTD. (JP) 1994-07-06 EP disclosed
EP-0578246-A1 Isothiazole derivatives and processes for preparing the same as well as termite controlling agents comprising the same as active ingredient NIHON NOHYAKU CO., LTD. (JP) 1994-01-12 EP disclosed