SCHEMBL29629318

SCHEMBL29629318

c1ccc(-c2ccc(-c3cccc(Nc4cccc5ccccc45)c3)cc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC25B P30305 3/20 0.70
▸ ALDH1A1 P00352 1/20 0.70
▸ TP53 P04637 1/20 0.70
▸ CYP3A4 P08684 1/20 0.70
▸ HPGD P15428 1/20 0.70
▸ ALOX15 P16050 1/20 0.70
▸ TSHR P16473 1/20 0.70
▸ ATM Q13315 1/20 0.70
▸ HSD17B10 Q99714 1/20 0.70
▸ FADS1 O60427 1/20 0.63
▸ KDM4E B2RXH2 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ GLA P06280 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ RECQL P46063 1/20 0.55
▸ TDP1 Q9NUW8 1/20 0.55
▸ SIRT2 Q8IXJ6 2/20 0.53
▸ SIRT1 Q96EB6 2/20 0.53

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
SCHEMBL24809293 1.00 CDC25B (0.70) CDC25BALDH1A1TP53CYP3A4HPGD
SCHEMBL17742371 0.98 CDC25B (0.72) CDC25BALDH1A1TP53CYP3A4HPGD
SCHEMBL21234645 0.91 CDC25B (0.62) CDC25BALDH1A1TP53CYP3A4HPGD
SCHEMBL10136239 0.90 ALDH1A1 (0.70) CDC25BALDH1A1TP53CYP3A4HPGD
Biphenyl SCHEMBL4619027 0.89 ALDH1A1 (0.88) CDC25BALDH1A1TP53CYP3A4HPGD
SCHEMBL12476447 0.89 ALDH1A1 (0.59) CDC25BALDH1A1TP53CYP3A4HPGD
SCHEMBL25124918 0.89 CDC25B (0.59) CDC25BALDH1A1TP53CYP3A4HPGD
SCHEMBL10136226 0.88 CDC25B (0.67) CDC25BALDH1A1TP53CYP3A4HPGD
SCHEMBL25248721 0.88 ALDH1A1 (0.79) CDC25BALDH1A1TP53CYP3A4HPGD
SCHEMBL21234531 0.88 CDC25B (0.67) CDC25BALDH1A1TP53CYP3A4HPGD

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-20220173325-A1 LIGHT EMITTING DIODE AND AMINE COMPOUND FOR THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2022-06-02 — — US disclosed
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