SCHEMBL23197833

SCHEMBL23197833

c1ccc(-c2ccc(-n3c4ccccc4c4cc5c6ccccc6n(-c6ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cn6)c5cc43)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.40
KDM4E B2RXH2 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HDAC4 P56524 1/20 0.35
RAC2 P15153 1/20 0.34
RAC3 P60763 1/20 0.34
CDC42 P60953 1/20 0.34
RAC1 P63000 1/20 0.34
NPC1 O15118 2/20 0.33
NFKB1 P19838 2/20 0.33
RAB9A P51151 2/20 0.33
NFKB2 Q00653 2/20 0.33
RELA Q04206 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
RXRA P19793 1/20 0.32
KMT2A Q03164 4/20 0.32
MAPT P10636 3/20 0.32
MEN1 O00255 3/20 0.32
ALDH1A1 P00352 2/20 0.32
HPGD P15428 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
SCHEMBL20060768 0.98 L3MBTL1 (0.43) ATMKDM4EL3MBTL1HDAC4RAC2
SCHEMBL17245464 0.96 L3MBTL1 (0.44) ATMKDM4EL3MBTL1HDAC4RAC2
SCHEMBL20060774 0.94 L3MBTL1 (0.44) ATMKDM4EL3MBTL1HDAC4RAC2
SCHEMBL20060775 0.93 KDM4E (0.39) ATMKDM4EL3MBTL1HDAC4NPC1
SCHEMBL17228228 0.93 L3MBTL1 (0.45) ATMKDM4EL3MBTL1RAC2RAC3
SCHEMBL18253606 0.92 RAC2 (0.33) ATMKDM4EL3MBTL1HDAC4RAC2
SCHEMBL20060832 0.92 RAC2 (0.33) ATMKDM4EL3MBTL1HDAC4RAC2
SCHEMBL23197788 0.92 KDM4E (0.37) ATMKDM4EL3MBTL1RAC2RAC3
SCHEMBL22459480 0.91 L3MBTL1 (0.45) ATMKDM4EL3MBTL1HDAC4RAC2
SCHEMBL20060830 0.91 RAC2 (0.34) ATMKDM4EL3MBTL1RAC2RAC3

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-20210104692-A1 ORGANIC LIGHT EMITTING DIODE DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2021-04-08 US disclosed