SCHEMBL8996655

SCHEMBL8996655

N#Cc1c(O)nsc1SCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.48
GAA P10253 2/20 0.48
ALPG P10696 1/20 0.48
HIF1A Q16665 1/20 0.47
KMT2A Q03164 6/20 0.47
MEN1 O00255 5/20 0.47
ALDH1A1 P00352 8/20 0.44
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 1/20 0.44
CYP1A2 P05177 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
MAOA P21397 2/20 0.43
MAOB P27338 2/20 0.43
CYP3A4 P08684 1/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
RET P07949 2/20 0.43
HPGD P15428 5/20 0.42

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
SCHEMBL8996605 0.77 MAOA (0.41) MAPTGAAALPGKMT2AMEN1
SCHEMBL9412193 0.77 MAPT (0.49) MAPTGAAALPGHIF1AKMT2A
SCHEMBL9412310 0.73 ALDH1A1 (0.45) MAPTGAAALPGHIF1AKMT2A
SCHEMBL10332462 0.73 ALDH1A1 (0.52) MAPTGAAALPGHIF1AKMT2A
SCHEMBL9412305 0.71 MAOB (0.44) MAPTGAAALPGHIF1AALDH1A1
SCHEMBL21917572 0.71 ALDH1A1 (0.52) MAPTGAAKMT2AMEN1ALDH1A1
SCHEMBL10332463 0.70 ALDH1A1 (0.59) MAPTGAAALPGHIF1AKMT2A
SCHEMBL5941105 0.70 HTT (0.53) MAPTGAAALPGKMT2AMEN1
SCHEMBL11561226 0.69 ALDH1A1 (0.36) MAPTGAAALPGKMT2AMEN1
SCHEMBL9332731 0.69 ALDH1A1 (0.36) MAPTGAAKMT2AMEN1ALDH1A1

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