SCHEMBL23960976

SCHEMBL23960976

c1ccc(-c2cccc(-c3cccc(-n4c5ccccc5c5c6c7ccccc7sc6c6c7ccccc7sc6c54)c3)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
RXFP1 Q9HBX9 1/20 0.37
TP53 P04637 2/20 0.35
ATM Q13315 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 1/20 0.34
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HTT P42858 2/20 0.32
HSD17B10 Q99714 1/20 0.32
FAAH O00519 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PKM P14618 1/20 0.32
MGLL Q99685 1/20 0.32
LIMK1 P53667 1/20 0.31
KMT2A Q03164 2/20 0.31
IL1R1 P14778 1/20 0.31
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31

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
SCHEMBL19985938 0.94 MAPT (0.36) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL19985937 0.93 MAPT (0.37) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL22960405 0.93 MAPT (0.37) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL22960418 0.92 MAPT (0.36) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL19985920 0.92 MAPT (0.36) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL16866932 0.90 L3MBTL1 (0.39) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL17405689 0.89 MAPT (0.34) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL17990901 0.88 MAPT (0.35) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL17405696 0.87 L3MBTL1 (0.38) MAPTRXFP1TP53ATML3MBTL1
SCHEMBL16867289 0.87 ALOX5 (0.46) MAPTRXFP1TP53TNKSTNKS2

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-20210336153-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2021-10-28 US disclosed