SCHEMBL17487741

SCHEMBL17487741

c1cc(-c2ccc(CNc3nc4cc(NC5COC5)ccc4[nH]3)cc2)[nH]n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
TP53 P04637 2/20 0.37
CHEK1 O14757 2/20 0.35
CDK7 P50613 1/20 0.35
PTGS2 P35354 2/20 0.34
HDAC6 Q9UBN7 1/20 0.34
ROCK2 O75116 3/20 0.34
ROCK1 Q13464 2/20 0.34
HTT P42858 1/20 0.33
GFER P55789 1/20 0.33
HIF1A Q16665 1/20 0.33
USP1 O94782 1/20 0.33
WDR48 Q8TAF3 1/20 0.33
TBK1 Q9UHD2 1/20 0.33
PIK3C3 Q8NEB9 1/20 0.32

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
SCHEMBL18965919 0.82 RAB9A (0.36) RAB9ALMNAMEN1NPC1KMT2A
SCHEMBL17487761 0.80 RAB9A (0.44) RAB9ALMNAMEN1NPC1KMT2A
SCHEMBL17487326 0.79 RAB9A (0.46) RAB9ALMNAMEN1NPC1KMT2A
SCHEMBL17487541 0.78 RAB9A (0.39) RAB9ALMNAMEN1NPC1KMT2A
SCHEMBL17487542 0.77 HTR6 (0.41) RAB9ALMNAMEN1NPC1KMT2A
SCHEMBL17487503 0.73 CNR2 (0.37) RAB9ALMNAMEN1NPC1KMT2A
SCHEMBL17487676 0.73 CYP3A4 (0.36) RAB9ALMNAMEN1NPC1KMT2A
SCHEMBL17488196 0.72 RAB9A (0.43) RAB9ALMNAMEN1NPC1KMT2A
SCHEMBL17487996 0.70 RAB9A (0.45) RAB9ALMNAMEN1NPC1KMT2A
SCHEMBL17488108 0.70 RAB9A (0.43) RAB9ALMNAMEN1NPC1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016016421-A1 2-AMINO-BENZIMIDAZOLE DERIVATIVES AND THEIR USE AS 5-LIPOXYGENASE AND/OR PROSTAGLANDIN E SYNTHASE INHIBITORS INSTITUT PASTEUR KOREA (KR) 2016-02-04 WO disclosed