SCHEMBL28023323

SCHEMBL28023323

O=C(c1ccccc1)c1ccc2c([nH]c3ccccc32)c1-c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
HPGD P15428 1/20 0.48
PARP14 Q460N5 1/20 0.47
MAP2 P11137 1/20 0.46
MPL P40238 1/20 0.45
PIM3 Q86V86 2/20 0.45
PIM1 P11309 1/20 0.45
MAPT P10636 1/20 0.43
GAA P10253 1/20 0.43
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
HTR2B P41595 1/20 0.42
HTR5A P47898 1/20 0.42
TDO2 P48775 1/20 0.42
KIF11 P52732 1/20 0.41
PBRM1 Q86U86 1/20 0.41
BCHE P06276 1/20 0.41
GABRP O00591 1/20 0.41
GABRD O14764 1/20 0.41

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
SCHEMBL28023856 0.85 WEE1 (0.50) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL28023304 0.84 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDPIM1MAPT
SCHEMBL28181009 0.84 PIM3 (0.59) ALDH1A1KDM4EHPGDMAP2MPL
SCHEMBL4866489 0.84 MPL (0.48) KDM4EPARP14MPLPIM3PIM1
SCHEMBL28241456 0.82 PARP14 (0.47) ALDH1A1KDM4EHPGDPARP14MAP2
SCHEMBL31485136 0.80 PBRM1 (0.58) PARP14MPLPIM3PIM1MAPT
SCHEMBL3910030 0.80 PBRM1 (0.58) PARP14MPLPIM3PIM1MAPT
SCHEMBL28876094 0.78 PARP14 (0.57) PARP14PBRM1
SCHEMBL28023310 0.78 KDM4E (0.54) ALDH1A1KDM4EHPGDMAPTGAA
Benzophenone SCHEMBL28907230 0.77 ALDH1A1 (0.50) ALDH1A1KDM4EHPGDMAP2MAPT

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-104744340-B Polysubstituted carbazole compound and preparation method and application 中国人民大学 2017-11-03 CN disclosed
CN-104744340-A Polysubstituted carbazole compound, preparation method and application thereof PEOPLES UNIV CHINA 2015-07-01 CN disclosed