SCHEMBL7016840

SCHEMBL7016840

O=[N+]([O-])c1cc(Br)ccc1Nc1c[c]ccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.48
HCAR3 P49019 1/20 0.46
WNK1 Q9H4A3 1/20 0.45
MAPT P10636 5/20 0.45
TDP1 Q9NUW8 3/20 0.45
POLB P06746 2/20 0.45
MAPK1 P28482 4/20 0.44
ALDH1A1 P00352 3/20 0.44
CASP7 P55210 1/20 0.44
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
IDO1 P14902 2/20 0.43
EGFR P00533 2/20 0.40
HSP90AA1 P07900 1/20 0.40
PKM P14618 1/20 0.39
RAB9A P51151 1/20 0.39
MYC P01106 1/20 0.39
GFER P55789 1/20 0.39
AKR1B10 O60218 1/20 0.39
AKR1B1 P15121 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
SCHEMBL337857 0.83 L3MBTL1 (0.68) L3MBTL1HCAR3WNK1MAPTTDP1
SCHEMBL15984934 0.81 EGFR (0.55) L3MBTL1HCAR3WNK1MAPTTDP1
SCHEMBL7018311 0.81 ALDH3A1 (0.58) L3MBTL1HCAR3WNK1MAPTTDP1
SCHEMBL11381627 0.79 IDO1 (0.58) L3MBTL1HCAR3WNK1MAPTTDP1
SCHEMBL27697298 0.78 EGFR (0.48) L3MBTL1HCAR3WNK1MAPTTDP1
SCHEMBL3323396 0.77 MAPT (0.51) L3MBTL1HCAR3WNK1MAPTTDP1
SCHEMBL14316100 0.76 ALDH1A1 (0.55) L3MBTL1HCAR3WNK1MAPTTDP1
SCHEMBL6383792 0.76 GAA (0.42) L3MBTL1MAPTTDP1ALDH1A1MEN1
SCHEMBL7100350 0.75 MAPT (0.43) L3MBTL1HCAR3MAPTTDP1POLB
SCHEMBL6427804 0.75 MAPT (0.44) L3MBTL1HCAR3WNK1MAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1326864-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
EP-1326606-A2 EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
WO-2002032422-A2 EP4 RECEPTOR INHIBITORS TO TREAT RHEUMATOID ARTHRITIS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed