SCHEMBL8996668

SCHEMBL8996668

CC(C)Sc1snc(OC[Si](C)(C)C)c1C#N

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FNTA P49354 8/20 0.33
FNTB P49356 8/20 0.33
ALDH1A1 P00352 3/20 0.33
MAPT P10636 4/20 0.32
HSD17B10 Q99714 2/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
MEN1 O00255 2/20 0.31
HPGD P15428 2/20 0.31
KMT2A Q03164 2/20 0.31
JAK2 O60674 1/20 0.31
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 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
SCHEMBL9412295 0.87 ALDH1A1 (0.33) ALDH1A1MAPTHSD17B10TP53TSHR
SCHEMBL9412224 0.77 FNTA (0.33) FNTAFNTBALDH1A1MAPTHSD17B10
SCHEMBL9412312 0.73 FNTA (0.31) FNTAFNTBALDH1A1
SCHEMBL8996612 0.72
SCHEMBL9412314 0.72 FNTA (0.31) FNTAFNTB
SCHEMBL9412217 0.70 FNTA (0.43) FNTAFNTBALDH1A1MAPTMEN1
SCHEMBL9412204 0.69 ALDH1A1 (0.39) ALDH1A1MAPTHSD17B10TP53TSHR
SCHEMBL9412276 0.69 ALDH1A1 (0.37) ALDH1A1MAPTHSD17B10TP53TSHR
SCHEMBL9412290 0.68 RECQL (0.34) ALDH1A1MAPTHSD17B10TP53TSHR
SCHEMBL9412299 0.68 ALDH1A1 (0.33) ALDH1A1MAPT

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 2 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