SCHEMBL21941868

SCHEMBL21941868

c1ccc(-n2c3ccccc3c3cc(-c4nc5ccccc5nc4-n4c5cc6ccccc6cc5c5cc6sc7ccccc7c6cc54)ccc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PTGER4 P35408 1/20 0.33
NPY5R Q15761 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
SCHEMBL21941971 0.96 KDM4E (0.34) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL21454973 0.92 KDM4E (0.37) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL21454942 0.90 KDM4E (0.37) KDM4EATML3MBTL1PTGER4
SCHEMBL19655278 0.90 KDM4E (0.38) KDM4EATML3MBTL1PTGER4
SCHEMBL21213185 0.90 ESR1 (0.32) KDM4E
SCHEMBL21213312 0.89 L3MBTL1 (0.43) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL21941897 0.88 TUBB4A (0.35)
SCHEMBL21212910 0.88 HPGD (0.33) KDM4E
SCHEMBL19234884 0.86 KDM4E (0.37) KDM4EATML3MBTL1PTGER4
SCHEMBL21941898 0.86 HRH4 (0.40) KDM4EL3MBTL1

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-2020085793-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME 덕산네오룩스 주식회사 2020-04-30 WO disclosed