SCHEMBL24029744

SCHEMBL24029744

c1ccc(-c2ccccc2Nc2cc3ccccc3c3ccccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 4/20 0.56
▸ FABP3 P05413 1/20 0.47
▸ FABP4 P15090 1/20 0.47
▸ FABP5 Q01469 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ CYP3A4 P08684 2/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ CYP2D6 P10635 2/20 0.44
▸ CYP2C19 P33261 2/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ HPGD P15428 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ MPI P34949 1/20 0.43
▸ ENTPD1 P49961 1/20 0.43
▸ ENTPD2 Q9Y5L3 1/20 0.43

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
SCHEMBL26021720 0.90 CDC25B (0.54) CDC25BFABP3FABP4FABP5ALDH1A1
SCHEMBL26157802 0.88 CDC25B (0.55) CDC25BFABP3FABP4FABP5ALDH1A1
SCHEMBL19152835 0.86 ALDH1A1 (0.47) CDC25BALDH1A1KDM4EMEN1KMT2A
SCHEMBL16657830 0.85 CDC25B (0.43) CDC25BFABP3FABP4FABP5ALDH1A1
SCHEMBL16760997 0.83 ALDH1A1 (0.57) CDC25BALDH1A1KDM4EMEN1KMT2A
SCHEMBL25433150 0.83 ALDH1A1 (0.44) CDC25BALDH1A1KDM4EMEN1KMT2A
SCHEMBL24029633 0.82 CDC25B (0.52) CDC25BFABP3FABP4FABP5ALDH1A1
SCHEMBL23822207 0.81 CDC25B (0.51) CDC25BFABP3FABP4FABP5ALDH1A1
SCHEMBL26021732 0.81 CDC25B (0.51) CDC25BFABP3FABP4FABP5ALDH1A1
SCHEMBL26021757 0.81 CDC25B (0.51) CDC25BFABP3FABP4FABP5ALDH1A1

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
WO-2021261907-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2021-12-30 — — WO disclosed
WO-2021230715-A1 ORGANIC LIGHT-EMITTING ELEMENT 주식회사 엘지화학 2021-11-18 — — WO disclosed
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