SCHEMBL24944400

SCHEMBL24944400

Clc1ccc(-c2ccc(-c3cccc(-c4ccccc4)c3)cc2)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.79
CNR1 P21554 4/20 0.55
ESR2 Q92731 1/20 0.52
KDM4E B2RXH2 2/20 0.50
LMNA P02545 1/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALOX5 P09917 1/20 0.50
MEN1 O00255 1/20 0.50
ESR1 P03372 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.50
MAPK13 O15264 1/20 0.49
GCGR P47871 1/20 0.49
MAPK12 P53778 1/20 0.49
MAPK11 Q15759 1/20 0.49
MAPK14 Q16539 1/20 0.49
ALDH1A1 P00352 2/20 0.48
POLB P06746 1/20 0.48
HTT P42858 1/20 0.48

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
SCHEMBL29365379 1.00 CYP1A2 (0.79) CYP1A2CNR1ESR2KDM4ELMNA
SCHEMBL16751944 1.00 CYP1A2 (0.79) CYP1A2CNR1ESR2KDM4ELMNA
SCHEMBL22173143 1.00 CYP1A2 (0.79) CYP1A2CNR1ESR2KDM4ELMNA
SCHEMBL29792066 0.97 CYP1A2 (0.75) CYP1A2CNR1ESR2KDM4ELMNA
SCHEMBL14309786 0.95 CYP1A2 (0.68) CYP1A2CNR1LMNAALOX5MEN1
SCHEMBL3956869 0.95 CYP1A2 (0.68) CYP1A2CNR1LMNAALOX5MEN1
SCHEMBL14302431 0.95 CYP1A2 (0.68) CYP1A2CNR1LMNAALOX5MEN1
SCHEMBL21663932 0.92 CYP1A2 (0.83) CYP1A2CNR1ESR2KDM4ELMNA
SCHEMBL15043307 0.92 CYP1A2 (0.83) CYP1A2CNR1ESR2KDM4ELMNA
SCHEMBL14905454 0.91 CYP1A2 (0.65) CYP1A2CNR1ESR2KDM4ELMNA

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
US-20230013038-A1 LIGHT EMITTING DEVICE AND AMINE COMPOUND FOR LIGHT EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2023-01-19 US disclosed