SCHEMBL286738

SCHEMBL286738

CS(=O)(=O)NN(CC(=O)c1cccs1)C(=O)c1ccc(=O)[nH]c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.38
RAB9A P51151 7/20 0.36
MEN1 O00255 3/20 0.36
NPC1 O15118 4/20 0.36
ALDH1A1 P00352 3/20 0.36
POLB P06746 3/20 0.36
LMNA P02545 2/20 0.36
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ERCC5 P28715 1/20 0.35
FEN1 P39748 1/20 0.35
CTNNB1 P35222 2/20 0.35
WNT3A P56704 2/20 0.35
GSK3B P49841 1/20 0.35
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
LIMK2 P53671 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
SCHEMBL287518 0.72 ALDH1A1 (0.35) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL287275 0.72 GSK3B (0.36) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL287418 0.72 ALDH1A1 (0.35) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL286928 0.70 ALDH1A1 (0.34) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL287292 0.70 ALDH1A1 (0.34) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL287118 0.69 KMT2A (0.33) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL287828 0.68 ALDH1A1 (0.38) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL9832503 0.63 ALDH1A1 (0.62) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL16408224 0.61 RAB9A (0.48) KMT2ARAB9AMEN1NPC1ALDH1A1
SCHEMBL711360 0.60 RAB9A (0.75) KMT2ARAB9AMEN1NPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2427432-A2 NOVEL HETEROCYCLIC COMPOUNDS Torrent Pharmaceuticals Limited (IN) 2012-03-14 EP claimed
WO-2010128528-A2 NOVEL HETEROCYCLIC COMPOUNDS TORRENT PHARMACEUTICALS LIMITED (IN) 2010-11-11 WO claimed
EP-2427432-A2 NOVEL HETEROCYCLIC COMPOUNDS Torrent Pharmaceuticals Limited (IN) 2012-03-14 EP disclosed
WO-2010128528-A2 NOVEL HETEROCYCLIC COMPOUNDS TORRENT PHARMACEUTICALS LIMITED (IN) 2010-11-11 WO disclosed