SCHEMBL9118166

SCHEMBL9118166

COc1ccc(-c2ccccc2)cc1Nc1ccc(C(F)(F)F)cc1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.56
KDM4E B2RXH2 5/20 0.56
L3MBTL1 Q9Y468 4/20 0.56
ALDH1A1 P00352 3/20 0.56
KMT2A Q03164 2/20 0.56
GAA P10253 2/20 0.56
MEN1 O00255 1/20 0.56
GFER P55789 1/20 0.56
KIF11 P52732 3/20 0.47
HDAC2 Q92769 1/20 0.44
HPGD P15428 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RAB9A P51151 1/20 0.44
ABCB1 P08183 1/20 0.44
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ABCC1 P33527 1/20 0.43
RECQL P46063 2/20 0.42
DUSP3 P51452 1/20 0.42
PTPN5 P54829 1/20 0.42

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
SCHEMBL8658226 0.87 MAPT (0.55) MAPTKDM4EL3MBTL1ALDH1A1KMT2A
SCHEMBL9116795 0.81 LMNA (0.55) MAPTKDM4EL3MBTL1ALDH1A1KMT2A
SCHEMBL9121209 0.81 MAPK1 (0.52) MAPTALDH1A1KMT2AMEN1HPGD
SCHEMBL9118789 0.80 ACLY (0.47) MAPTKDM4EL3MBTL1ALDH1A1KMT2A
Hydrochloric Acid SCHEMBL9559137 0.80 LMNA (0.54) MAPTKDM4EL3MBTL1ALDH1A1KMT2A
SCHEMBL6141350 0.72 CFTR (0.64) MAPTKDM4EL3MBTL1ALDH1A1KMT2A
SCHEMBL9121222 0.72 MAPK1 (0.53) MAPTKDM4EALDH1A1KMT2AMEN1
SCHEMBL330883 0.72 L3MBTL1 (0.70) MAPTKDM4EL3MBTL1ALDH1A1KMT2A
SCHEMBL19507651 0.71 MAPK8 (0.39) MAPTKDM4EL3MBTL1ALDH1A1KMT2A
SCHEMBL4459254 0.71 KDM4E (0.59) MAPTKDM4EL3MBTL1ALDH1A1KMT2A

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
EP-0477819-B1 Benzimidazole derivatives, their preparation and use NEUROSEARCH AS (DK) 1995-03-15 EP disclosed
US-5200422-A Benzimidazole derivatives, their preparation and use NEUROSEARCH A/S (DK) 1993-04-06 US disclosed
EP-0477819-A2 Benzimidazole derivatives, their preparation and use NEUROSEARCH A/S (DK) 1992-04-01 EP disclosed