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SCHEMBL19001823

SCHEMBL19001823

c1ccc(-c2cccc3c2-c2ccccc2C32c3ccccc3-c3c(-n4c5ccccc5c5cc(-c6ccc7c(c6)c6ccccc6n7-c6ccccc6)ccc54)cccc32)cc1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ KMT2A Q03164 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.31
▸ TSPO P30536 1/20 0.31
▸ IL1R1 P14778 1/20 0.30
▸ PTGER4 P35408 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HTT P42858 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
SCHEMBL18457468 0.94 L3MBTL1 (0.40) L3MBTL1KDM4EATMKMT2AALDH1A1
SCHEMBL15213654 0.94 KDM4E (0.42) L3MBTL1KDM4EATMKMT2AALDH1A1
SCHEMBL19530819 0.93 KDM4E (0.41) L3MBTL1KDM4EATMKMT2AALDH1A1
SCHEMBL16810649 0.93 KDM4E (0.41) L3MBTL1KDM4EATMKMT2AALDH1A1
SCHEMBL23222575 0.93 L3MBTL1 (0.43) L3MBTL1KDM4EATMKMT2AALDH1A1
SCHEMBL21104419 0.92 KDM4E (0.37) L3MBTL1KDM4EATMKMT2AALDH1A1
SCHEMBL25941077 0.92 KDM4E (0.38) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL19001827 0.92 KDM4E (0.38) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL23222653 0.91 KDM4E (0.40) L3MBTL1KDM4EATMKMT2ATSPO
SCHEMBL8784649 0.91 TSPO (0.36) L3MBTL1KDM4EATMALDH1A1TSPO

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-2017102063-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-06-22 — — WO disclosed