SCHEMBL29048957

SCHEMBL29048957

NNC(=O)c1ccc2c3ccc(C(=O)NN)c4c(C(=O)NN)ccc(c5ccc(C(=O)NN)c1c25)c43

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.48
▸ GFER P55789 3/20 0.48
▸ MAPT P10636 6/20 0.47
▸ KDM4E B2RXH2 5/20 0.47
▸ GAA P10253 3/20 0.41
▸ CTSD P07339 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ MITF O75030 1/20 0.41
▸ NCOA1 Q15788 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ NCOA3 Q9Y6Q9 1/20 0.41
▸ MPO P05164 2/20 0.40
▸ CYP3A4 P08684 2/20 0.40
▸ P2RX7 Q99572 1/20 0.40
▸ KDM5A P29375 1/20 0.40
▸ BLM P54132 1/20 0.40

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
SCHEMBL29048960 0.92 CYP1A2 (0.54) ALDH1A1GFERMAPTKDM4EGAA
SCHEMBL9404064 0.92 CYP1A2 (0.54) ALDH1A1GFERMAPTKDM4EGAA
SCHEMBL30565112 0.92 CYP1A2 (0.54) ALDH1A1GFERMAPTKDM4EGAA
SCHEMBL1046705 0.91 ALDH1A1 (0.56) ALDH1A1GFERMAPTKDM4EGAA
SCHEMBL29921916 0.82 ALDH1A1 (0.48) ALDH1A1GFERMAPTKDM4EGAA
SCHEMBL31411203 0.75 ALDH1A1 (0.61) ALDH1A1GFERMAPTKDM4EGAA
SCHEMBL31411201 0.75 ALDH1A1 (0.61) ALDH1A1GFERMAPTKDM4EGAA
SCHEMBL466508 0.74 MAPT (0.52) ALDH1A1GFERMAPTKDM4EGAA
SCHEMBL11226254 0.74 ALDH1A1 (0.46) ALDH1A1GFERMAPTKDM4EGAA
SCHEMBL9838361 0.74 PLK1 (0.41) ALDH1A1KDM4EGAAKMT2ACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116581386-B Additive for lithium metal battery, electrolyte and lithium metal battery 北京民利储能技术有限公司 2024-05-28 — — CN claimed
CN-116581386-A Additive for lithium metal battery, electrolyte and lithium metal battery 北京民利储能技术有限公司 2023-08-11 — — CN claimed
CN-116581386-B Additive for lithium metal battery, electrolyte and lithium metal battery 北京民利储能技术有限公司 2024-05-28 — — CN disclosed
CN-116581386-A Additive for lithium metal battery, electrolyte and lithium metal battery 北京民利储能技术有限公司 2023-08-11 — — CN disclosed
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