SCHEMBL12376511

SCHEMBL12376511

CC(C)c1ccc2c(c1)c1ccccc1n2-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
ATM Q13315 1/20 0.47
RORA P35398 1/20 0.43
RORC P51449 1/20 0.43
RORB Q92753 1/20 0.43
PTPN1 P18031 2/20 0.40
HDAC4 P56524 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KIF11 P52732 1/20 0.38
TNKS O95271 1/20 0.35
PARP1 P09874 1/20 0.35
TNKS2 Q9H2K2 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
RAC2 P15153 1/20 0.35
RAC3 P60763 1/20 0.35
CDC42 P60953 1/20 0.35
RAC1 P63000 1/20 0.35

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
SCHEMBL21249247 0.91 KDM4E (0.53) KDM4EL3MBTL1ATMRORARORC
SCHEMBL20152246 0.91 KDM4E (0.47) KDM4EL3MBTL1ATMRORARORC
SCHEMBL17228087 0.91 KDM4E (0.47) KDM4EL3MBTL1ATMRORARORC
SCHEMBL1102407 0.90 KDM4E (0.60) KDM4EL3MBTL1ATMRORARORC
SCHEMBL9916266 0.90 KDM4E (0.53) KDM4EL3MBTL1ATMPTPN1HDAC4
SCHEMBL262641 0.89 KDM4E (0.41) KDM4EL3MBTL1ATMRORARORC
SCHEMBL262810 0.89 KDM4E (0.41) KDM4EL3MBTL1ATMRORARORC
SCHEMBL22260172 0.89 KDM4E (0.55) KDM4EL3MBTL1ATMRORARORC
SCHEMBL9916264 0.88 KDM4E (0.53) KDM4EL3MBTL1ATMRORARORC
SCHEMBL17228761 0.88 RXRA (0.43) KDM4EL3MBTL1ATMRORARORC

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-2022073065-A1 TRIPLET QUENCHER THE UNIVERSITY OF QUEENSLAND (AU) 2022-04-14 WO disclosed
US-20110196104-A1 Norbornene-based copolymers with iridium complexes and exiton transport groups in their side-chains and use thereof GEORGIA TECH RESEARCH CORPORATION (US) 2011-08-11 US disclosed