SCHEMBL24949586

SCHEMBL24949586

Clc1ccc(-n2c3ccccc3c3ccc4ccccc4c32)cc1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 2/20 0.38
KDM4E B2RXH2 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ATM Q13315 1/20 0.36
CYP2A6 P11509 3/20 0.35
MAPT P10636 3/20 0.34
CYP1A2 P05177 3/20 0.32
CYP1A1 P04798 2/20 0.32
CYP1B1 Q16678 2/20 0.32
RPA1 P27694 1/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HTT P42858 1/20 0.32
HSD17B10 Q99714 1/20 0.31
HPGD P15428 2/20 0.31
MEN1 O00255 1/20 0.31
MPI P34949 1/20 0.31

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
SCHEMBL24948955 0.90 MAPK14 (0.38) MAPK14KDM4EL3MBTL1ATMCYP2A6
SCHEMBL24947184 0.86 CYP1A1 (0.35) MAPK14KDM4EL3MBTL1ATMMAPT
SCHEMBL23319036 0.85 KDM4E (0.50) MAPK14KDM4EL3MBTL1ATMCYP2A6
SCHEMBL24947202 0.84 MAPK14 (0.38) MAPK14KDM4EL3MBTL1ATMCYP2A6
SCHEMBL22851315 0.84 KDM4E (0.35) KDM4EL3MBTL1ATMMAPTALDH1A1
SCHEMBL24374431 0.83 L3MBTL1 (0.37) MAPK14KDM4EL3MBTL1ATMCYP2A6
SCHEMBL25879780 0.83 KDM4E (0.43) MAPK14KDM4EL3MBTL1ATMMAPT
SCHEMBL24948348 0.82 KDM4E (0.41) MAPK14KDM4EL3MBTL1ATMCYP2A6
SCHEMBL24949595 0.81 MAPK14 (0.43) MAPK14KDM4EL3MBTL1ATMCYP2A6
SCHEMBL20825820 0.80 KDM4E (0.42) KDM4EL3MBTL1ATMCYP2A6CYP1A2

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-2023002447-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed
WO-2023003403-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-01-26 WO disclosed