SCHEMBL28097403

SCHEMBL28097403

Cc1ccc(-c2cccc(-c3ccnn3-c3ccc(C)cc3)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 2/20 0.51
ALDH1A1 P00352 2/20 0.49
MAPT P10636 2/20 0.49
ATM Q13315 1/20 0.49
MAPK9 P45984 2/20 0.49
MAPK10 P53779 2/20 0.49
MAPK8 P45983 1/20 0.49
MAPK14 Q16539 4/20 0.46
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM5A P29375 2/20 0.43
KDM4C Q9H3R0 2/20 0.43
KDM5B Q9UGL1 2/20 0.43
KDM4A O75164 1/20 0.43
MDM2 Q00987 1/20 0.42
NT5E P21589 1/20 0.41
NR3C1 P04150 1/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL28097404 0.93 NR3C1 (0.50) NR3C2ALDH1A1MAPTATMMAPK9
SCHEMBL28097405 0.89 MEN1 (0.50) NR3C2ALDH1A1MAPTATMMAPK9
SCHEMBL28097351 0.89 NR3C2 (0.46) NR3C2ALDH1A1MAPTATMMAPK9
SCHEMBL28097416 0.88 KDM5A (0.49) NR3C2ALDH1A1MAPTATMMAPK9
SCHEMBL17086629 0.85 MAPT (0.54) NR3C2ALDH1A1MAPTATMMAPK9
SCHEMBL28097406 0.84 NR3C2 (0.51) NR3C2ALDH1A1MAPK9MAPK10MAPK8
SCHEMBL15556699 0.84 NR3C2 (0.54) NR3C2ALDH1A1MAPTMAPK9MAPK10
SCHEMBL12759885 0.83 MDM2 (0.52) NR3C2ALDH1A1MAPTATMMAPK9
SCHEMBL28004022 0.83 MAPK9 (0.54) NR3C2ALDH1A1MAPK9MAPK10MAPK8
SCHEMBL17086633 0.80 MDM2 (0.52) NR3C2ALDH1A1MAPTATMMAPK9

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-104487438-B Benzisoxazole modulators of neurogenesis 霍夫曼-拉罗奇有限公司 2016-10-19 CN claimed
CN-104487438-B Benzisoxazole modulators of neurogenesis 霍夫曼-拉罗奇有限公司 2016-10-19 CN disclosed