SCHEMBL9826530

SCHEMBL9826530

Nc1ccc2c(c1)NC(=O)C(Cc1ccccc1)O2

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.49
HSD17B10 Q99714 4/20 0.47
ALOX15 P16050 2/20 0.47
PARP1 P09874 1/20 0.46
GSK3B P49841 1/20 0.44
MAPK1 P28482 3/20 0.43
ALDH1A1 P00352 1/20 0.42
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
THRB P10828 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
HTT P42858 1/20 0.40
XIAP P98170 1/20 0.40
BIRC2 Q13490 1/20 0.40
TSHR P16473 2/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL5670687 0.83 ALDH1A1 (0.56) BRD4HSD17B10PARP1MAPK1ALDH1A1
SCHEMBL9826121 0.80 KMT2A (0.57) BRD4HSD17B10ALOX15PARP1MAPK1
SCHEMBL2101384 0.78 L3MBTL1 (0.63) HSD17B10ALOX15MAPK1USP2GAA
SCHEMBL9827097 0.77 PPARG (0.53) BRD4HSD17B10ALOX15PARP1ALDH1A1
SCHEMBL9825998 0.75 MAOB (0.63) BRD4HSD17B10ALOX15PARP1MAPK1
SCHEMBL17434397 0.73 KMT2A (0.67) BRD4HSD17B10ALOX15MAPK1ALDH1A1
SCHEMBL5799536 0.73 USP2 (0.76) HSD17B10USP2GAAMEN1KMT2A
SCHEMBL24124663 0.72 THRB (0.41) HSD17B10ALOX15ALDH1A1MEN1KMT2A
SCHEMBL9826341 0.72 USP2 (0.46) BRD4HSD17B10ALOX15PARP1MAPK1
SCHEMBL2104033 0.72 PARP1 (0.60) BRD4PARP1USP2GAAMEN1

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-0283036-B1 BENZOXAZINE DERIVATIVES AND PROCESSES FOR PREPARATION THEREOF TANABE SEIYAKU CO., LTD. (JP) 1991-09-11 EP disclosed
US-4824833-A ANTIDIABETIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1989-04-25 US disclosed
EP-0283036-A1 Benzoxazine derivatives and processes for preparation thereof TANABE SEIYAKU CO., LTD. (JP) 1988-09-21 EP disclosed