SCHEMBL23340437

SCHEMBL23340437

C/C=C\C(=C/C)N1C(=O)c2cccc3c(-c4ccc(-c5ccc6c7c(cccc57)C(=O)N(c5ccccc5)C6=O)cc4)ccc(c23)C1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.51
▸ KDM4E B2RXH2 7/20 0.51
▸ L3MBTL1 Q9Y468 4/20 0.51
▸ POLB P06746 3/20 0.51
▸ RECQL P46063 2/20 0.51
▸ CASP6 P55212 2/20 0.51
▸ TDP1 Q9NUW8 2/20 0.51
▸ APOBEC3A P31941 1/20 0.51
▸ APOBEC3G Q9HC16 1/20 0.51
▸ KMT2A Q03164 13/20 0.50
▸ MEN1 O00255 12/20 0.50
▸ USP2 O75604 10/20 0.50
▸ KEAP1 Q14145 5/20 0.50
▸ NFE2L2 Q16236 5/20 0.50
▸ HTT P42858 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ GAA P10253 2/20 0.49
▸ LMNA P02545 2/20 0.45
▸ TNNI3 P19429 2/20 0.45

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
SCHEMBL20735208 0.83 KMT2A (0.69) ALDH1A1KDM4EL3MBTL1POLBRECQL
SCHEMBL20735011 0.81 KMT2A (0.68) ALDH1A1KDM4EL3MBTL1POLBRECQL
SCHEMBL20735007 0.81 KMT2A (0.68) ALDH1A1KDM4EL3MBTL1POLBRECQL
SCHEMBL20735068 0.80 KMT2A (0.69) ALDH1A1KDM4EL3MBTL1POLBRECQL
SCHEMBL23340366 0.79 CYP11B1 (0.43) ALDH1A1KDM4EL3MBTL1POLBTDP1
SCHEMBL20735409 0.79 KMT2A (0.68) ALDH1A1KDM4EL3MBTL1POLBRECQL
SCHEMBL20735010 0.77 KMT2A (0.61) ALDH1A1KDM4EL3MBTL1POLBRECQL
SCHEMBL20735173 0.77 KMT2A (0.61) ALDH1A1KDM4EL3MBTL1POLBRECQL
SCHEMBL20735223 0.77 KMT2A (0.65) ALDH1A1KDM4EL3MBTL1POLBRECQL
SCHEMBL20735090 0.75 KMT2A (0.76) ALDH1A1KDM4EL3MBTL1POLBRECQL

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
EP-3442047-B1 ORGANIC LIGHT-EMITTING DISPLAY APPARATUS SAMSUNG DISPLAY CO LTD (KR) 2021-05-05 — — EP disclosed
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