SCHEMBL9683129

SCHEMBL9683129

Nc1cc(Cl)ccc1NCc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
ALDH1A1 P00352 2/20 0.43
TSHR P16473 2/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HDAC8 Q9BY41 1/20 0.42
APP P05067 2/20 0.42
TP53 P04637 1/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
POLB P06746 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP1A2 P05177 1/20 0.41
RECQL P46063 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL9682901 0.90 MAPT (0.43) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL11569274 0.90 ALDH1A1 (0.49) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL11274390 0.89 PKM (0.52) MAPTALDH1A1SMN1; SMN2APPKDM4E
SCHEMBL9681992 0.86 HDAC8 (0.42) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL9683512 0.86 TP53 (0.46) ALDH1A1TSHRTP53
SCHEMBL9681343 0.86 HDAC3 (0.44) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL9683167 0.86 HTT (0.51) MAPTL3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL9683493 0.86 MEN1 (0.59) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL7171578 0.82 CNR1 (0.47) MAPTL3MBTL1TDP1MEN1KMT2A
SCHEMBL9682485 0.82 GAA (0.51) MAPTMEN1KMT2ASMN1; SMN2HDAC8

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