SCHEMBL29875769

SCHEMBL29875769

CC(C)(C)c1ccc(-c2ccc(Oc3ccc4c5c(cccc35)C(=O)OC4=O)c(N)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.39
▸ POLB P06746 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ TYMS P04818 4/20 0.37
▸ MAPT P10636 3/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ S1PR1 P21453 1/20 0.34
▸ MCL1 Q07820 2/20 0.34
▸ PRMT1 Q99873 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ PABPC1 P11940 1/20 0.33
▸ XBP1 P17861 1/20 0.33
▸ NFKB1 P19838 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ SMARCA2 P51531 1/20 0.33
▸ NFKB2 Q00653 1/20 0.33
▸ RELA Q04206 1/20 0.33

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
SCHEMBL29886848 0.92 KMT2A (0.43) KMT2APOLBMEN1TYMSMAPT
SCHEMBL24634087 0.92 KMT2A (0.43) KMT2APOLBMEN1TYMSMAPT
SCHEMBL29876440 0.83 ALDH1A1 (0.45) KMT2APOLBMEN1TYMSMAPT
SCHEMBL29875713 0.82 L3MBTL1 (0.48) KMT2APOLBMEN1TYMSMAPT
SCHEMBL14303997 0.78 KMT2A (0.49) KMT2APOLBMEN1TYMSMAPT
SCHEMBL24633993 0.77 TYMS (0.43) KMT2APOLBMEN1TYMSMAPT
SCHEMBL16684611 0.77 TYMS (0.47) KMT2APOLBMEN1TYMSMAPT
SCHEMBL30557400 0.77 TYMS (0.47) KMT2APOLBMEN1TYMSMAPT
SCHEMBL25432363 0.76 ALDH1A1 (0.48) KMT2APOLBMEN1TYMSMAPT
SCHEMBL29876284 0.73 KMT2A (0.46) KMT2APOLBMEN1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117063288-A Boron-containing cyclic light-emitting compound and color conversion film comprising same 日东电工株式会社 2023-11-14 — — CN disclosed
WO-2023049828-A1 BORON-CONTAINING CYCLIC EMISSIVE COMPOUNDS AND COLOR CONVERSION FILM CONTAINING THE SAME NITTO DENKO CORPORATION (US) 2023-03-30 — — WO disclosed
WO-2022178450-A1 BORON-CONTAINING CYCLIC EMISSIVE COMPOUNDS AND COLOR CONVERSION FILM CONTAINING THE SAME NITTO DENKO CORPORATION (JP) 2022-08-25 — — WO disclosed
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