SCHEMBL13624663

SCHEMBL13624663

O=C(O)c1cccc(-n2ncc3cc(O)ccc32)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 7/20 0.49
MAPK8 P45983 6/20 0.49
HPGD P15428 2/20 0.47
NR3C1 P04150 2/20 0.47
PGR P06401 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA6 P23280 1/20 0.46
CA9 Q16790 1/20 0.46
MGLL Q99685 1/20 0.44
SMO Q99835 1/20 0.43
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
GAA P10253 2/20 0.42
KMT2A Q03164 2/20 0.42
HSD17B10 Q99714 2/20 0.42
USP2 O75604 1/20 0.42
MYC P01106 1/20 0.42

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
SCHEMBL13623928 0.88 MAPK10 (0.48) MAPK10MAPK8HPGDNR3C1PGR
SCHEMBL836830 0.85 MAPK10 (0.48) MAPK10MAPK8HPGDMGLLSMO
SCHEMBL2610311 0.81 MGLL (0.57) MAPK10MAPK8HPGDNR3C1MGLL
SCHEMBL13623919 0.81 MAPK10 (0.67) MAPK10MAPK8SMO
SCHEMBL6840245 0.80 HPGDS (0.60) MAPK10MAPK8HPGDNR3C1PGR
SCHEMBL121760 0.80 KHK (0.55) MAPK10MAPK8HPGDNR3C1MGLL
SCHEMBL13624667 0.80 MAPK10 (0.51) MAPK10MAPK8NR3C1PGRSMO
SCHEMBL13624505 0.79 MAPK10 (0.55) MAPK10MAPK8SMOHPGDS
SCHEMBL13624666 0.78 NR3C1 (0.49) MAPK10MAPK8NR3C1SMOHPGDS
SCHEMBL13624133 0.78 MAPK10 (0.54) MAPK10MAPK8SMOHPGDS

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
WO-2016124722-A1 A PROCESS FOR THE PREPARATION OF 3-5-{[(1R,2S)-2-[(2,2-DIFLUOROPROPANYL)AMINO]-1 -(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL]PROPYL]OXY}-1H-INDAZOL-1-YL)-N-[(3R)-TETRAHYDROFURAN-3-YL] BENZAMIDE ASTRAZENECA AB (SE) 2016-08-11 WO disclosed
WO-2009142569-A1 PHENYL OR PYRIDINYL SUBSTITUTED INDAZOLES DERIVATIVES ASTRAZENECA AB (SE) 2009-11-26 WO disclosed