SCHEMBL9683008

SCHEMBL9683008

O=[N+]([O-])c1cc(F)ccc1NCc1ccc(Cl)cc1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.67
L3MBTL1 Q9Y468 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
LMNA P02545 3/20 0.56
POLB P06746 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
ALDH1A1 P00352 3/20 0.54
HTR6 P50406 3/20 0.50
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
HPGD P15428 1/20 0.47
CYP2C19 P33261 1/20 0.47
RECQL P46063 1/20 0.47
BLM P54132 1/20 0.47

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
SCHEMBL9683242 0.88 MAPT (0.84) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL9683160 0.86 MAPT (0.54) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL9682931 0.86 MAPT (0.58) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL12658349 0.86 MAPT (0.53) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL9682260 0.83 MAPT (0.67) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL9683146 0.83 MAPT (0.57) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL7335661 0.83 MAPT (0.63) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL9681404 0.83 MAPT (0.56) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL10508498 0.81 MAPT (0.67) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL9682067 0.81 MAPT (0.76) MAPTL3MBTL1TDP1MEN1KMT2A

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-5128359-A Benzimidazole and azabenzimidazole derivatives which are thromboxane receptor antagonists, their methods of preparation LABORATOIRES UPSA (FR) 1992-07-07 US disclosed
US-5124336-A Cardiovascular disorders LABORATOIRES UPSA (FR) 1992-06-23 US disclosed
US-5021443-A Noval benzimidazole and azabenzimiazole derivatives which are thromboxane receptor antagonists, their methods of preparation and pharmaceutical compositions in which they are present LABORATOIRES UPSA (FR) 1991-06-04 US disclosed