SCHEMBL8945823

SCHEMBL8945823

C#CCOc1nsc(SC(F)F)c1C#N

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
JAK2 O60674 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL8945442 0.84
SCHEMBL8996632 0.81 ALDH1A1 (0.42) ALDH1A1MEN1JAK2POLBGAA
SCHEMBL9412255 0.81 SQOR (0.34) ALDH1A1MEN1JAK2POLBGAA
SCHEMBL9412295 0.81 ALDH1A1 (0.33) ALDH1A1MEN1JAK2POLBGAA
SCHEMBL9412276 0.78 ALDH1A1 (0.37) ALDH1A1MEN1GAAMAPTHPGD
SCHEMBL9412247 0.78 RECQL (0.36) ALDH1A1MEN1JAK2POLBGAA
SCHEMBL9412298 0.77 ALDH1A1 (0.36) ALDH1A1MAPTHPGDHSD17B10
SCHEMBL9412299 0.77 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL9412290 0.75 RECQL (0.34) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL9412283 0.74 ALDH1A1 (0.35) ALDH1A1MEN1MAPTHPGDKMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5578622-A FUNGICIDE OR BACTERICIDE FOR USE IN INDUSTRY, AGRICULTURE AND MEDICINE ASAMURA PATENT OFFICE (JP) 1996-11-26 US disclosed
EP-0697409-A1 Isothiazole derivatives containing (an) iodoalkylnyl group(s), their preparation and their use as fungicide and/or bactericide NIHON NOHYAKU CO., LTD. (JP) 1996-02-21 EP disclosed
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