SCHEMBL8345523

SCHEMBL8345523

CC(c1ccc(Cl)cc1)c1nc(-c2c(F)cccc2Cl)nn1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GPBAR1 Q8TDU6 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
ALOX5AP P20292 4/20 0.34
PTGES O14684 4/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3R1 P27986 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33

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
SCHEMBL8346452 0.87 GPBAR1 (0.36) NPC1CASP3RAB9ASENP8SENP7
SCHEMBL9049609 0.84 GPBAR1 (0.34) NPC1CASP3RAB9ASENP8SENP7
SCHEMBL9011758 0.77 NPC1 (0.37) NPC1CASP3RAB9ASENP8SENP7
SCHEMBL9046768 0.74 ALDH1A1 (0.39) NPC1RAB9AL3MBTL1GPBAR1MEN1
SCHEMBL8345513 0.74 NPC1 (0.37) NPC1CASP3RAB9ASENP8SENP7
SCHEMBL8345626 0.73 NPC1 (0.36) NPC1CASP3RAB9ASENP8SENP7
SCHEMBL8341803 0.73 GPBAR1 (0.43) NPC1CASP3RAB9ASENP8SENP7
SCHEMBL8304433 0.72 HSD11B1 (0.51) NR1H2NR1H3PTGESMEN1KMT2A
SCHEMBL8341274 0.71 KMT2A (0.39) NPC1CASP3RAB9ASENP8SENP7
SCHEMBL8484561 0.71 GPBAR1 (0.35) NPC1CASP3RAB9ASENP8SENP7

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
US-5892048-A INSECTICIDES, MITICIDES NIPPON SODA CO., LTD. (JP) 1999-04-06 US disclosed
EP-0717039-A1 NOVEL TRIAZOLE COMPOUND, PROCESS FOR PRODUCING THE SAME, AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 1996-06-19 EP disclosed