SCHEMBL4200739

SCHEMBL4200739

Cc1nc(NC(=O)c2cccc(Cl)c2)sc1C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.69
KMT2A Q03164 9/20 0.69
MAPT P10636 5/20 0.69
ALDH1A1 P00352 4/20 0.69
KDM4E B2RXH2 4/20 0.69
HSP90AA1 P07900 1/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
NPC1 O15118 6/20 0.62
RAB9A P51151 5/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
GCK P35557 1/20 0.60
GRM5 P41594 1/20 0.60
LCK P06239 2/20 0.58
RXFP1 Q9HBX9 2/20 0.58
NPSR1 Q6W5P4 1/20 0.58
PKM P14618 2/20 0.56
TDP1 Q9NUW8 2/20 0.56
POLB P06746 1/20 0.56
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55

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
SCHEMBL3581515 0.87 RAB9A (0.81) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL3582729 0.85 NPC1 (0.73) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL3581996 0.85 KDM4E (0.67) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL3580760 0.84 SCD (0.65) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL4346190 0.84 NPC1 (0.80) MEN1KMT2AALDH1A1KDM4ENPC1
SCHEMBL3591591 0.84 NPC1 (0.64) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL4188640 0.84 NPC1 (0.60) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL27727775 0.82 MEN1 (0.51) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL3583698 0.82 KMT2A (1.00) MEN1KMT2AMAPTALDH1A1KDM4E
SCHEMBL4193912 0.82 RAB9A (0.59) MEN1KMT2AMAPTALDH1A1KDM4E

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
EP-2029138-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2009-03-04 EP disclosed
WO-2007130075-A1 AMINOTHIAZOLE DERIVATIVES AS HUMAN STEAROYL-COA DESATURASE INHIBITORS XENON PHARMACEUTICALS INC. (CA) 2007-11-15 WO disclosed