SCHEMBL6589193

SCHEMBL6589193

CC(Br)CCCCCc1nc2ccccc2[nH]1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.69
NR2F2 P24468 1/20 0.53
DDAH1 O94760 1/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C19 P33261 1/20 0.51
PKM P14618 3/20 0.50
PDE10A Q9Y233 1/20 0.49
MAPT P10636 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL6753939 0.87 POLB (0.75) POLBDDAH1NPC1RAB9ACYP2D6
SCHEMBL6586384 0.86 POLB (0.69) POLBNR2F2DDAH1NPC1RAB9A
SCHEMBL2331252 0.84 POLB (0.96) POLBNR2F2DDAH1NPC1RAB9A
SCHEMBL30701864 0.84 POLB (0.96) POLBNR2F2DDAH1NPC1RAB9A
SCHEMBL7856315 0.84 POLB (0.96) POLBNR2F2DDAH1NPC1RAB9A
SCHEMBL30701863 0.84 POLB (0.96) POLBNR2F2DDAH1NPC1RAB9A
SCHEMBL7856311 0.84 POLB (0.96) POLBNR2F2DDAH1NPC1RAB9A
SCHEMBL7854826 0.84 POLB (0.96) POLBNR2F2DDAH1NPC1RAB9A
SCHEMBL8973669 0.83 POLB (0.65) POLBNR2F2DDAH1NPC1RAB9A
SCHEMBL7006523 0.83 POLB (1.00) POLBDDAH1NPC1RAB9ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6815455-B1 ANTIFOAM AGENTS OF MACROPHAGES; PREVENTING ARTERIOSCLEROSIS FUJI PHOTO FILM CO., LTD. (JP) 2004-11-09 US disclosed
EP-1197487-B1 BENZIMIDAZOLE COMPOUNDS AND DRUGS CONTAINING THE SAME FUJI PHOTO FILM CO LTD (JP) 2004-01-14 EP disclosed
EP-1197487-A1 BENZIMIDAZOLE COMPOUNDS AND DRUGS CONTAINING THE SAME Fuji Photo Film Co., Ltd. (JP) 2002-04-17 EP disclosed