SCHEMBL29501302

SCHEMBL29501302

N#Cc1cccc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
ATM Q13315 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
DRD2 P14416 2/20 0.47
DRD3 P35462 1/20 0.47
RPS6KB1 P23443 1/20 0.46
NOTUM Q6P988 1/20 0.46
MAT2A P31153 2/20 0.42
GRM5 P41594 6/20 0.42
NSD2 O96028 1/20 0.42
TSHR P16473 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 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
SCHEMBL1201648 1.00 KDM4E (0.53) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL18381882 0.98 KDM4E (0.52) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL10330893 0.94 KDM4E (0.47) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL25905725 0.91 KDM4E (0.44) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL15250593 0.91 KDM4E (0.44) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL17297084 0.91 KDM4E (0.53) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL29002850 0.90 KDM4E (0.47) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL22001436 0.89 DRD3 (0.43) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL22385213 0.89 KDM4E (0.46) KDM4EATML3MBTL1DRD2DRD3
SCHEMBL29457590 0.88 KDM4E (0.48) KDM4EATML3MBTL1DRD2DRD3

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-112239452-B Electron transport type heteroanthracene derivative and organic electroluminescent device thereof 武汉尚赛光电科技有限公司 2022-05-10 CN disclosed