SCHEMBL24973447

SCHEMBL24973447

CCc1cccc(-c2ccccc2)c1-c1ccc(-n2c3ccccc3c3ccc4ccccc4c32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 3/20 0.36
BAD Q92934 3/20 0.36
KMT2A Q03164 1/20 0.35
CHRNB2 P17787 1/20 0.34
CHRNA4 P43681 1/20 0.34
KDM4E B2RXH2 3/20 0.33
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
MAPK14 Q16539 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK8 P45983 1/20 0.33
RCE1 Q9Y256 1/20 0.33
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL24949595 0.83 MAPK14 (0.43) KMT2AKDM4EMAPK14ATML3MBTL1
SCHEMBL18803903 0.82 MAPT (0.36) KMT2AKDM4ERCE1ALDH1A1CYP1A2
SCHEMBL23702385 0.81 L3MBTL1 (0.44) KMT2AKDM4EATML3MBTL1ALDH1A1
SCHEMBL19271550 0.81 KDM4E (0.41) MCL1KDM4EPPARGPPARAMAPK14
SCHEMBL27451924 0.79 KDM4E (0.44) MCL1KDM4EPPARGPPARAMAPK14
SCHEMBL24949613 0.79 CA12 (0.36) MCL1KDM4EPPARGPPARAMAPK14
SCHEMBL24949620 0.79 CA12 (0.36) MCL1KDM4EPPARGPPARAMAPK14
SCHEMBL15073677 0.78 KDM4E (0.49) MCL1KDM4EPPARGPPARAMAPK14
SCHEMBL20009818 0.78 L3MBTL1 (0.37) KMT2AKDM4EMAPK14ATML3MBTL1
SCHEMBL20812940 0.78 L3MBTL1 (0.37) KMT2AKDM4EMAPK14ATML3MBTL1

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