SCHEMBL28845693

SCHEMBL28845693

Cc1cccc(NC(=O)c2cccc(Nc3ccnc4cc(C(F)(F)F)ccc34)c2)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
HTT P42858 1/20 0.61
RAB9A P51151 1/20 0.61
DNMT1 P26358 3/20 0.58
DNMT3A Q9Y6K1 3/20 0.58
KCNK3 O14649 2/20 0.57
KCNK9 Q9NPC2 1/20 0.57
EHMT1 Q9H9B1 2/20 0.53
DNMT3L Q9UJW3 2/20 0.53
RXFP1 Q9HBX9 2/20 0.52
BRAF P15056 4/20 0.51
GSK3A P49840 2/20 0.51
GSK3B P49841 2/20 0.51
AURKA O14965 1/20 0.49
GAK O14976 1/20 0.49
MAPT P10636 2/20 0.49
POLB P06746 1/20 0.48
APEX1 P27695 1/20 0.48
PRKD3 O94806 1/20 0.48

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
SCHEMBL29809955 1.00 MEN1 (0.61) MEN1KMT2AHTTRAB9ADNMT1
SCHEMBL28845675 0.90 DNMT1 (0.68) RAB9ADNMT1DNMT3AKCNK3EHMT1
SCHEMBL28845668 0.88 GAA (0.60) MEN1KMT2ADNMT1DNMT3AEHMT1
SCHEMBL29200469 0.87 GAK (0.55) DNMT1DNMT3AGSK3AGSK3BAURKA
SCHEMBL28845688 0.86 DNMT1 (0.63) DNMT1DNMT3AEHMT1DNMT3LRXFP1
SCHEMBL29809945 0.86 RXFP1 (0.56) MEN1KMT2AHTTRAB9ADNMT1
SCHEMBL28845662 0.86 RXFP1 (0.56) MEN1KMT2AHTTRAB9ADNMT1
SCHEMBL29809959 0.85 RXFP1 (0.55) MEN1KMT2ARAB9ADNMT1DNMT3A
SCHEMBL28845641 0.85 RXFP1 (0.55) MEN1KMT2ARAB9ADNMT1DNMT3A
SCHEMBL28845637 0.84 DNMT1 (0.52) DNMT1DNMT3AEHMT1DNMT3LGSK3A

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
CN-114773267-A [ (7-trifluoromethyl quinoline-4-yl) amino ] benzamide compound and preparation and application thereof 沈阳药科大学 2022-07-22 CN claimed
CN-114773267-B [ (7-trifluoromethyl quinoline-4-yl) amino ] benzamide compound and preparation and application thereof 沈阳药科大学 2024-01-26 CN disclosed
CN-114773267-A [ (7-trifluoromethyl quinoline-4-yl) amino ] benzamide compound and preparation and application thereof 沈阳药科大学 2022-07-22 CN disclosed