SCHEMBL27716636

SCHEMBL27716636

CC(C)(C)OOC(=O)c1ccc(-c2ccccc2)cc1NC(=O)c1cccc(-n2cccn2)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 2/20 0.45
TEK Q02763 1/20 0.42
TBK1 Q9UHD2 3/20 0.39
ACLY P53396 2/20 0.39
DGAT2 Q96PD7 1/20 0.39
HDAC1 Q13547 6/20 0.38
FFAR4 Q5NUL3 1/20 0.38
HDAC2 Q92769 2/20 0.38
IKBKE Q14164 2/20 0.38
NTRK1 P04629 1/20 0.38
SUCNR1 Q9BXA5 1/20 0.38
HDAC3 O15379 1/20 0.38
MAPK14 Q16539 1/20 0.37

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
SCHEMBL27830397 0.88 KAT6A (0.44) KAT6ATEKDGAT2HDAC1
SCHEMBL27696807 0.86 SMN1; SMN2 (0.51) ACLY
SCHEMBL2274841 0.85 ACLY (0.54) KAT6ATEKTBK1ACLYHDAC1
SCHEMBL27716759 0.80 SERPINE1 (0.44) ACLYHDAC1HDAC2HDAC3
SCHEMBL27696974 0.79 SERPINE1 (0.46) ACLYHDAC1HDAC2HDAC3
SCHEMBL12117628 0.79 TBK1 (0.46) KAT6ATBK1ACLYHDAC1IKBKE
SCHEMBL1316849 0.79 TBK1 (0.42) KAT6ATBK1ACLYHDAC1HDAC2
SCHEMBL27848558 0.78 HDAC2 (0.51) ACLYHDAC1HDAC2HDAC3
SCHEMBL27696987 0.77 ACLY (0.51) ACLYHDAC1HDAC2SUCNR1HDAC3
SCHEMBL27716642 0.77 ACLY (0.53) ACLYHDAC1HDAC2SUCNR1HDAC3

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
CN-101094829-B novel anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO.,LTD. (JP) 2012-02-08 CN disclosed
CN-101094829-A Novel anthranilic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD (JP) 2007-12-26 CN disclosed