SCHEMBL28023307

SCHEMBL28023307

CCOC(=O)c1ccc2c([nH]c3ccccc32)c1-c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
AR P10275 7/20 0.54
IDO1 P14902 1/20 0.51
MAPT P10636 2/20 0.51
ALDH1A1 P00352 2/20 0.48
POLB P06746 2/20 0.48
KDM4E B2RXH2 2/20 0.46
NPC1 O15118 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HCRTR1 O43613 1/20 0.44
RAB9A P51151 1/20 0.44

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
SCHEMBL28023310 0.87 KDM4E (0.54) LMNAMAPTALDH1A1KDM4ENPC1
SCHEMBL3888738 0.81 AR (0.59) LMNAARMAPTALDH1A1KDM4E
SCHEMBL8387303 0.77 KDM4E (0.59) LMNAMAPTALDH1A1KDM4ENPC1
SCHEMBL3555503 0.76 AR (0.58) LMNAARMAPTALDH1A1POLB
SCHEMBL28023857 0.74 MEN1 (0.55) LMNAMAPTALDH1A1KDM4ENPC1
SCHEMBL6045360 0.74 KDM4E (0.62) LMNAMAPTALDH1A1KDM4ENPC1
SCHEMBL30804630 0.74 KDM4E (0.62) LMNAMAPTALDH1A1KDM4ENPC1
SCHEMBL28023305 0.74 KIF11 (0.53) MAPTALDH1A1KDM4ESMN1; SMN2MEN1
Benzene SCHEMBL30804625 0.73 KDM4E (0.60) LMNAMAPTALDH1A1KDM4ENPC1
SCHEMBL7637488 0.73 MAPT (0.59) ARMAPTNPC1SMN1; SMN2RAB9A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104744340-A Polysubstituted carbazole compound, preparation method and application thereof PEOPLES UNIV CHINA 2015-07-01 CN disclosed