SCHEMBL22140889

SCHEMBL22140889

Brc1cccc2sc3ccc(-n4c5ccccc5c5ccc6c7ccccc7n(-c7ccccc7)c6c54)cc3c12

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.33
▸ MAPT P10636 2/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ PDE1B Q01064 1/20 0.30
▸ PDE3A Q14432 1/20 0.30
▸ PDE11A Q9HCR9 1/20 0.30

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
SCHEMBL26542966 0.87 ATM (0.40) ATML3MBTL1KDM4EHSD17B10MAPT
SCHEMBL18850140 0.85 L3MBTL1 (0.36) ATML3MBTL1KDM4EHSD17B10MAPT
SCHEMBL15462295 0.85 ATM (0.47) ATML3MBTL1KDM4EHSD17B10MAPT
SCHEMBL26514956 0.85 L3MBTL1 (0.38) ATML3MBTL1KDM4EHSD17B10MAPT
SCHEMBL26286667 0.84 ATM (0.44) ATML3MBTL1KDM4EHSD17B10MAPT
SCHEMBL9890468 0.83 ATM (0.46) ATML3MBTL1KDM4EHSD17B10MEN1
SCHEMBL17253020 0.82 ATM (0.43) ATML3MBTL1KDM4EHSD17B10MAPT
SCHEMBL26514653 0.82 ALOX5 (0.36) ATML3MBTL1KDM4EHSD17B10MAPT
SCHEMBL17246535 0.82 ATM (0.45) ATML3MBTL1KDM4EHSD17B10MAPT
SCHEMBL18910376 0.82 KDM4E (0.37) ATML3MBTL1KDM4E

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
WO-2020127165-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-06-25 — — WO disclosed
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