SCHEMBL7256296

SCHEMBL7256296

Cc1ccc(Nc2ncccc2S(N)(=O)=O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.64
NPC1 O15118 4/20 0.61
RAB9A P51151 3/20 0.61
MAPT P10636 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
AHR P35869 1/20 0.61
HPGD P15428 1/20 0.60
HTT P42858 1/20 0.60
LMNA P02545 3/20 0.57
AR P10275 1/20 0.56
CA2 P00918 4/20 0.55
CA1 P00915 3/20 0.55
CA9 Q16790 3/20 0.55
CA12 O43570 1/20 0.55
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 3/20 0.53
KDM4E B2RXH2 2/20 0.53
ENPP3 O14638 3/20 0.48
TP53 P04637 1/20 0.48

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
SCHEMBL15067758 0.86 NPC1 (0.69) NPSR1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL29745666 0.86 NPC1 (0.69) NPSR1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL29682998 0.77 LMNA (0.58) NPSR1NPC1MAPTHPGDHTT
SCHEMBL14247202 0.77 LMNA (0.58) NPSR1NPC1MAPTHPGDHTT
SCHEMBL29898269 0.76 RAB9A (1.00) NPSR1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL28824955 0.76 RAB9A (1.00) NPSR1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL11643488 0.76 RAB9A (0.60) NPSR1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL8251220 0.76 CA12 (0.62) NPSR1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL5157536 0.74 TBXA2R (0.53) NPSR1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL2227362 0.73 CA1 (0.58) NPSR1NPC1MAPTHPGDHTT

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
WO-2003097603-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE TORSEMIDE FINETECH LABORATORIES LTD. (IL) 2003-11-27 WO claimed
WO-2003097603-A1 PROCESS FOR THE PREPARATION OF HIGHLY PURE TORSEMIDE FINETECH LABORATORIES LTD. (IL) 2003-11-27 WO disclosed