SCHEMBL23960945

SCHEMBL23960945

c1ccc(-n2c3ccc4c5ccccc5n(-c5ccc(-c6cccc7oc8ccccc8c67)cc5)c4c3c3ccc4ccccc4c32)cc1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
BACE1 P56817 1/20 0.33
LMNA P02545 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL23961023 1.00 L3MBTL1 (0.34) L3MBTL1KDM4EATMTDP1SIRT2
SCHEMBL23960937 0.93 L3MBTL1 (0.35) L3MBTL1KDM4EATMTDP1SIRT2
SCHEMBL23960987 0.92 SIRT2 (0.34) L3MBTL1KDM4EATMTDP1SIRT2
SCHEMBL23309090 0.91 KDM4E (0.41) L3MBTL1KDM4EATMBACE1LMNA
SCHEMBL24356181 0.91 KDM4E (0.41) L3MBTL1KDM4EATMBACE1LMNA
SCHEMBL18505325 0.90 ALOX5 (0.38) L3MBTL1KDM4EATMTDP1SIRT2
SCHEMBL22186487 0.90 ALOX5 (0.38) L3MBTL1KDM4EATMTDP1SIRT2
SCHEMBL22926989 0.89 L3MBTL1 (0.36) L3MBTL1KDM4EATMTDP1SIRT2
SCHEMBL17990284 0.87 L3MBTL1 (0.37) L3MBTL1KDM4EATMTDP1SIRT2
SCHEMBL25775321 0.87 KDM4E (0.37) L3MBTL1KDM4EATMBACE1

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