SCHEMBL21154356

SCHEMBL21154356

N=C(/N=C(\Nn1c2ccc(-c3ccccc3)cc2c2cc(-c3ccc4c(c3)c3cc(-c5ccccc5)ccc3n4-c3ccccc3)ccc21)c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NR4A2 P43354 2/20 0.31
PTGER4 P35408 1/20 0.31
WDR5 P61964 1/20 0.31
KLKB1 P03952 1/20 0.30

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
SCHEMBL21153953 0.98 KDM4E (0.32) KDM4EATML3MBTL1NR4A2
SCHEMBL21153946 0.94 KDM4E (0.32) KDM4EATML3MBTL1NR4A2
SCHEMBL21154296 0.94 KDM4E (0.32) KDM4EATML3MBTL1NR4A2
SCHEMBL21153900 0.92 L3MBTL1 (0.40) KDM4EATML3MBTL1PTGER4
SCHEMBL21154295 0.92 KDM4E (0.31) KDM4EATML3MBTL1NR4A2PTGER4
SCHEMBL21153895 0.92 L3MBTL1 (0.36) KDM4EATML3MBTL1PTGER4
SCHEMBL21153897 0.89 KDM4E (0.38) KDM4EATML3MBTL1PTGER4
SCHEMBL21153943 0.89 TSPO (0.30)
SCHEMBL21153951 0.88 NR4A2 (0.31) NR4A2
SCHEMBL21154289 0.86 ALDH1A1 (0.33) KLKB1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2568030-B1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING SAME, AND DISPLAY DEVICE INCLUDING ORGANIC LIGHT EMITTING DIODE CHEIL IND INC (KR) 2019-12-25 EP disclosed
EP-3514846-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING SAME, AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT EMITTING DIODE Cheil Industries Inc. (KR) 2019-07-24 EP disclosed
EP-3509121-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING SAME, AND DISPLAY DEVICE INCLUDING THE ORGANIC LIGHT EMITTING DIODE Cheil Industries Inc. (KR) 2019-07-10 EP disclosed