SCHEMBL10972788

SCHEMBL10972788

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

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.40
NPC1 O15118 5/20 0.40
GAA P10253 3/20 0.40
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ALOX5 P09917 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 2/20 0.34
PLA2G7 Q13093 1/20 0.34
GUSB P08236 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL10884215 0.78 PLA2G7 (0.57) RAB9ANPC1ALDH1A1LMNAMAPT
SCHEMBL10972790 0.74 RAB9A (0.41) RAB9ANPC1GAAALDH1A1TP53
SCHEMBL10887029 0.69 CYP1A2 (0.44) RAB9ANPC1ALDH1A1SMN1; SMN2LMNA
SCHEMBL12756958 0.68
SCHEMBL10889083 0.67 ALDH1A1 (0.44) RAB9ANPC1GAAALDH1A1SMN1; SMN2
SCHEMBL6836844 0.66 GUSB (0.51) RAB9ANPC1GAAALOX5MAPT
SCHEMBL6836849 0.66 GUSB (0.51) RAB9ANPC1GAAALOX5MAPT
SCHEMBL642752 0.65
SCHEMBL2448729 0.65
SCHEMBL5365100 0.65

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