SCHEMBL28845668

SCHEMBL28845668

Cc1ccccc1NC(=O)c1cccc(Nc2ccnc3cc(C(F)(F)F)ccc23)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.60
DNMT1 P26358 3/20 0.57
DNMT3A Q9Y6K1 3/20 0.57
BRAF P15056 5/20 0.52
EHMT1 Q9H9B1 2/20 0.50
DNMT3L Q9UJW3 2/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
APEX1 P27695 1/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
CSF1R P07333 2/20 0.48
AURKA O14965 1/20 0.48
KIT P10721 1/20 0.48
GAK O14976 2/20 0.48
GSK3A P49840 2/20 0.48
GSK3B P49841 2/20 0.48
PRKD3 O94806 1/20 0.48
MAP4K4 O95819 1/20 0.48
MARK3 P27448 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
SCHEMBL28845675 0.89 DNMT1 (0.68) DNMT1DNMT3AEHMT1DNMT3LMAPT
SCHEMBL28845667 0.89 KCNK3 (0.55) GAADNMT1DNMT3ABRAFEHMT1
SCHEMBL29809955 0.88 MEN1 (0.61) DNMT1DNMT3ABRAFEHMT1DNMT3L
SCHEMBL28845693 0.88 MEN1 (0.61) DNMT1DNMT3ABRAFEHMT1DNMT3L
SCHEMBL28845678 0.84 TAS2R14 (0.52) GAADNMT1MAPTGAKGSK3A
SCHEMBL29809961 0.84 TAS2R14 (0.52) GAADNMT1MAPTGAKGSK3A
SCHEMBL29200469 0.84 GAK (0.55) DNMT1DNMT3AAURKAGAKGSK3A
SCHEMBL28845688 0.84 DNMT1 (0.63) DNMT1DNMT3AEHMT1DNMT3LAURKA
SCHEMBL28845637 0.83 DNMT1 (0.52) DNMT1DNMT3AEHMT1DNMT3LPOLB
SCHEMBL28845648 0.83 NPSR1 (0.56) DNMT1DNMT3AEHMT1DNMT3LAURKA

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