SCHEMBL7404351

SCHEMBL7404351

COCc1noc(-c2ccccc2N)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.45
NPC1 O15118 6/20 0.45
RAB9A P51151 6/20 0.45
TDP1 Q9NUW8 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
SMN1; SMN2 Q16637 6/20 0.44
MAPK1 P28482 2/20 0.44
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
CHRM2 P08172 2/20 0.43
CHRM4 P08173 2/20 0.43
CHRM5 P08912 2/20 0.43
CHRM1 P11229 2/20 0.43
CHRM3 P20309 2/20 0.43
ACE2 Q9BYF1 1/20 0.42
CHUK O15111 1/20 0.41
TXNRD1 Q16881 1/20 0.41
NOX4 Q9NPH5 1/20 0.41
ALDH1A1 P00352 3/20 0.39
SMPD1 P17405 1/20 0.39

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
SCHEMBL9948682 0.79 NOTUM (0.45) L3MBTL1NPC1RAB9ATDP1NPSR1
SCHEMBL9949734 0.79 NPC1 (0.44) L3MBTL1NPC1RAB9ATDP1NPSR1
SCHEMBL13232016 0.79 L3MBTL1 (0.44) L3MBTL1NPC1RAB9ATDP1NPSR1
SCHEMBL7394051 0.78 TDP1 (0.54) L3MBTL1NPC1RAB9ATDP1SMN1; SMN2
SCHEMBL2094070 0.78 NOTUM (0.62) L3MBTL1NPC1RAB9ATDP1SMN1; SMN2
SCHEMBL14600787 0.76 BCHE (0.46) L3MBTL1NPC1RAB9ASMN1; SMN2BCHE
SCHEMBL5334470 0.75 ACHE (0.56) L3MBTL1NPC1RAB9ANPSR1SMN1; SMN2
SCHEMBL2062074 0.74 ACHE (0.53) L3MBTL1NPC1RAB9ATDP1SMN1; SMN2
SCHEMBL9949703 0.72 PPARG (0.46) L3MBTL1NPC1RAB9ATDP1NPSR1
SCHEMBL8402282 0.71 CHUK (0.40) L3MBTL1NPC1RAB9ATDP1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0419397-B1 Substituted urea compounds and their preparation and use NOVO NORDISK AS (DK) 1994-06-08 EP claimed
US-5330990-A Antagonists of 5-HT and 5-HT3 receptors, psychological disorders, antinausea NOVO NORDISK A/S (DK) 1994-07-19 US disclosed
EP-0419397-B1 Substituted urea compounds and their preparation and use NOVO NORDISK AS (DK) 1994-06-08 EP disclosed
EP-0491770-A1 SUBSTITUTED UREA COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1992-07-01 EP disclosed
EP-0419397-A1 Substituted urea compounds and their preparation and use NOVO NORDISK A/S (DK) 1991-03-27 EP disclosed
WO-1991003475-A1 SUBSTITUTED UREA COMPOUNDS AND THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1991-03-21 WO disclosed