SCHEMBL21846226

SCHEMBL21846226

c1ccc(-c2c3ccccc3c(-c3ccc4c(c3)c3cc(-c5c6ccccc6cc6ccccc56)ccc3n4-c3ccccc3)c3ccccc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ ATM Q13315 1/20 0.47
▸ ALOX5 P09917 2/20 0.46
▸ KMT2A Q03164 5/20 0.43
▸ ESR1 P03372 4/20 0.38
▸ ESR2 Q92731 4/20 0.38
▸ IL1R1 P14778 1/20 0.37
▸ MEN1 O00255 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ GPR84 Q9NQS5 2/20 0.35
▸ PTGER4 P35408 1/20 0.35
▸ HPGD P15428 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TSHR P16473 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34

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
SCHEMBL28009925 0.95 L3MBTL1 (0.52) KDM4EL3MBTL1ATMALOX5KMT2A
SCHEMBL15449929 0.92 L3MBTL1 (0.55) KDM4EL3MBTL1ATMKMT2AESR1
Benzene SCHEMBL21800968 0.91 L3MBTL1 (0.53) KDM4EL3MBTL1ATMALOX5KMT2A
SCHEMBL9890872 0.91 L3MBTL1 (0.53) KDM4EL3MBTL1ATMALOX5KMT2A
SCHEMBL21450742 0.90 L3MBTL1 (0.53) KDM4EL3MBTL1ATMKMT2AESR1
SCHEMBL16521307 0.90 L3MBTL1 (0.47) KDM4EL3MBTL1ATMALOX5KMT2A
SCHEMBL13761995 0.89 L3MBTL1 (0.52) KDM4EL3MBTL1ATMKMT2AESR1
SCHEMBL13761978 0.89 L3MBTL1 (0.52) KDM4EL3MBTL1ATMKMT2AESR1
SCHEMBL13761977 0.89 L3MBTL1 (0.52) KDM4EL3MBTL1ATMKMT2AESR1
SCHEMBL411647 0.89 L3MBTL1 (0.62) KDM4EL3MBTL1ATMKMT2AIL1R1

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-2020054676-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 学校法人関西学院 2020-03-19 — — WO disclosed
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