SCHEMBL13511564

SCHEMBL13511564

CN1c2cc(N(c3ccccc3)c3ccc(-c4cccc5ccccc45)cc3)ccc2-c2ccc3c4c(ccc1c24)Nc1cc(N(c2ccccc2)c2ccc(-c4cccc5ccccc45)cc2)ccc1-3

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 1/20 0.31
▸ MCL1 Q07820 1/20 0.31
▸ ACMSD Q8TDX5 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ RXRA P19793 1/20 0.30
▸ PPARG P37231 1/20 0.30
▸ PPARA Q07869 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
SCHEMBL13508082 0.90 MCL1 (0.36) ALKMCL1ACMSDKDM4ERXRA
SCHEMBL13511623 0.84 KDM4E (0.32) KDM4E
SCHEMBL13511689 0.84 — —
SCHEMBL13511410 0.79 MEN1 (0.30) —
SCHEMBL13507523 0.77 SIGMAR1 (0.36) KDM4E
SCHEMBL13507531 0.77 ALDH1A1 (0.33) KDM4E
SCHEMBL13507645 0.77 ALDH1A1 (0.36) ALKKDM4E
SCHEMBL13507603 0.75 MCL1 (0.40) ALKMCL1ACMSDKDM4EPPARG
SCHEMBL13507521 0.74 AKT1 (0.33) KDM4E
SCHEMBL13508088 0.74 CA12 (0.43) ALKMCL1ACMSDPPARGPPARA

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-2145936-A2 Fluorene and pyrene derivatives and organic electroluminescent device using the same Gracel Display Inc. (KR) 2010-01-20 — — EP disclosed
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