SCHEMBL24657865

SCHEMBL24657865

c1ccc(N(c2ccc3ccc4ccc5ccccc5c4c3c2)c2ccc3ccc4sc5ccccc5c4c3c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NQO1 P15559 1/20 0.36
▸ NQO2 P16083 1/20 0.36
▸ GPR3 P46089 1/20 0.34
▸ MAPT P10636 3/20 0.33
▸ TDP1 Q9NUW8 2/20 0.33
▸ MCL1 Q07820 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ DUSP3 P51452 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ PTPN5 P54829 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PTPN11 Q06124 1/20 0.33
▸ CTDSP1 Q9GZU7 1/20 0.33
▸ CYP1A2 P05177 2/20 0.32
▸ ELANE P08246 1/20 0.32
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ ALDH1A1 P00352 2/20 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
SCHEMBL24657035 0.96 NQO1 (0.36) NQO1NQO2GPR3MAPTTDP1
SCHEMBL24656536 0.96 NQO1 (0.34) NQO1NQO2GPR3MAPTTDP1
SCHEMBL25879227 0.94 GPR3 (0.38) NQO1NQO2GPR3MAPTTDP1
SCHEMBL25879233 0.92 GPR3 (0.34) NQO1NQO2GPR3MAPTTDP1
SCHEMBL25883167 0.92 GPR3 (0.40) NQO1NQO2GPR3MAPTTDP1
SCHEMBL15852623 0.92 NQO2 (0.36) NQO1NQO2GPR3MAPTTDP1
SCHEMBL24658265 0.91 CDK4 (0.36) NQO1NQO2MCL1
SCHEMBL24657726 0.90 NQO2 (0.34) NQO1NQO2MCL1CYP1A2MAOA
SCHEMBL25886418 0.90 MAPT (0.38) NQO1NQO2GPR3MAPTTDP1
SCHEMBL24655632 0.89 F9 (0.36) NQO1NQO2MCL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4243100-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-09-13 — — EP disclosed
WO-2022177374-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2022-08-25 — — WO disclosed
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