SCHEMBL9883255

SCHEMBL9883255

CC1(C)c2cc3c(cc2-c2cc4c5ccccc5n(-c5cccc(-c6nc(-c7ccccc7)cc(-c7ccccc7)n6)c5)c4cc21)c1c(n3-c2cccc(-c3nc(-c4ccccc4)cc(-c4ccccc4)n3)c2)CCC=C1

nearest known ligand 0.30

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL9883202 0.99 — —
SCHEMBL10175316 0.92 — —
SCHEMBL9883184 0.89 — —
SCHEMBL13195911 0.87 KDM4E (0.38) KDM4E
SCHEMBL15257579 0.87 MEN1 (0.39) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL22698887 0.86 — —
SCHEMBL13493190 0.86 KDM4E (0.38) KDM4E
SCHEMBL15257530 0.86 KDM4E (0.39) KDM4EMEN1ALDH1A1LMNAMAPT
SCHEMBL22448033 0.85 — —
SCHEMBL12990707 0.85 KDM4E (0.33) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012136295-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2012-10-11 — — WO disclosed
WO-2012069121-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-05-31 — — WO disclosed
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