SCHEMBL10972790

SCHEMBL10972790

O=C(O)C(Cl)=C(Cl)Cl.ON=Cc1ccsc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.41
NPC1 O15118 5/20 0.41
GAA P10253 3/20 0.41
KMT2A Q03164 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
MEN1 O00255 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
LCK P06239 1/20 0.34
FYN P06241 1/20 0.34
DAO P14920 1/20 0.34
LMNA P02545 1/20 0.33
ALOX5 P09917 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
SCHEMBL642752 0.81
SCHEMBL5365100 0.81
SCHEMBL2448729 0.81
Benzaldehyde Oxime SCHEMBL10888268 0.78 KMT2A (0.48) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
Benzaldehyde Oxime SCHEMBL10888243 0.78 KMT2A (0.48) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL10972788 0.74 RAB9A (0.40) RAB9ANPC1GAAKMT2ASMN1; SMN2
SCHEMBL10887035 0.68 CYP1A2 (0.45) RAB9ANPC1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL10886974 0.68 KMT2A (0.41) RAB9AKMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL9653616 0.67 RAB9A (0.61) RAB9ANPC1GAAKMT2ASMN1; SMN2
SCHEMBL9653612 0.67 RAB9A (0.61) RAB9ANPC1GAAKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0136640-A2 Trichloroacryloyloxime derivatives, process for their preparation and fungicides for agriculture NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1985-04-10 EP disclosed