SCHEMBL8810396

SCHEMBL8810396

Clc1nc(-c2ccco2)ns1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.52
NPC1 O15118 2/20 0.52
RAB9A P51151 2/20 0.52
APAF1 O14727 1/20 0.52
NSD2 O96028 1/20 0.52
CACNA1B Q00975 1/20 0.52
APBA1 Q02410 1/20 0.52
SAE1 Q9UBE0 1/20 0.52
UBA2 Q9UBT2 1/20 0.52
HSD17B10 Q99714 6/20 0.47
MAPT P10636 6/20 0.47
ALDH1A1 P00352 6/20 0.47
KDM4E B2RXH2 5/20 0.47
HPGD P15428 4/20 0.47
MEN1 O00255 3/20 0.47
PKM P14618 3/20 0.47
ALOX15 P16050 3/20 0.47
CASP1 P29466 3/20 0.47
BLM P54132 3/20 0.47
CASP7 P55210 3/20 0.47

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
SCHEMBL9852104 0.79 MAPT (0.53) POLBNPC1RAB9AAPAF1NSD2
SCHEMBL6529837 0.79 POLB (0.50) POLBNPC1RAB9AAPAF1NSD2
SCHEMBL15364087 0.79 CASP3 (0.52) POLBNPC1RAB9AAPAF1NSD2
SCHEMBL15364410 0.74 ALOX15 (0.54) POLBNPC1RAB9AAPAF1NSD2
SCHEMBL9091999 0.73 ALDH1A1 (0.45) POLBNPC1RAB9AAPAF1NSD2
SCHEMBL3263006 0.72 ALOX15 (0.43) POLBNPC1RAB9AAPAF1NSD2
SCHEMBL15364221 0.72 ALOX15 (0.43) POLBNPC1RAB9AAPAF1NSD2
SCHEMBL15364034 0.72 ALOX15 (0.43) POLBNPC1RAB9AAPAF1NSD2
SCHEMBL3250295 0.72 NPC1 (0.40) POLBNPC1RAB9AAPAF1NSD2
SCHEMBL1489493 0.72 POLB (0.56) POLBNPC1RAB9AAPAF1NSD2

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
CN-1188394-A Arthropodicidal and fungicidal cyclic amides DU PONT (US) 1998-07-22 CN disclosed
WO-1997000612-A1 ARTHROPODICIDAL AND FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-01-09 WO disclosed