SCHEMBL7541469

SCHEMBL7541469

CC(=O)Nc1ccc(OC(c2nc3ccccc3s2)C(C)C)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.57
▸ MAPT P10636 9/20 0.49
▸ NPC1 O15118 5/20 0.49
▸ MEN1 O00255 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ ALDH1A1 P00352 4/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.49
▸ PKM P14618 1/20 0.49
▸ NFKB1 P19838 1/20 0.49
▸ NFKB2 Q00653 1/20 0.49
▸ RELA Q04206 1/20 0.49
▸ ADORA1 P30542 1/20 0.49
▸ DYRK1A Q13627 1/20 0.49
▸ KDM4E B2RXH2 3/20 0.47
▸ GAA P10253 3/20 0.46
▸ HTT P42858 2/20 0.45
▸ ALOX5 P09917 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ EPHX2 P34913 1/20 0.44

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
SCHEMBL7543912 0.88 RAB9A (0.72) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL27363078 0.85 RAB9A (0.55) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL7574398 0.85 RAB9A (0.50) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL7550290 0.83 RAB9A (0.53) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL7544139 0.79 RAB9A (0.69) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL7544243 0.73 RAB9A (0.64) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL7544458 0.73 NPC1 (0.79) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL7541686 0.72 DYRK1A (0.54) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL27363079 0.72 MAPT (0.52) RAB9AMAPTNPC1MEN1KMT2A
SCHEMBL27477218 0.72 MAPT (0.52) RAB9AMAPTNPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795550-B1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO CO (JP) 2002-06-05 — — EP disclosed
EP-0795550-A1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO COMPANY LIMITED (JP) 1997-09-17 — — EP disclosed
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