SCHEMBL20405039

SCHEMBL20405039

CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4cc5ccccc5cc4C(=N)/N=C(\N)c4ccccc4)c4ccccc34)cc21

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.32
▸ ACMSD Q8TDX5 1/20 0.32
▸ PDK2 Q15119 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
SCHEMBL20404840 0.90 PDK2 (0.34) PDK2
SCHEMBL20405290 0.84 MCL1 (0.34) MCL1ACMSDPDK2
SCHEMBL20404836 0.83 PDK2 (0.33) PDK2
SCHEMBL23655275 0.79 SLC6A2 (0.33) MCL1ACMSDPDK2
SCHEMBL20407141 0.78 PDK2 (0.33) PDK2
SCHEMBL20204500 0.77 PDK2 (0.36) PDK2
SCHEMBL20405174 0.77 PDK2 (0.34) PDK2
SCHEMBL22930624 0.77 WDR5 (0.39) PDK2
SCHEMBL20404908 0.76 F2 (0.31) —
SCHEMBL17345759 0.74 WDR5 (0.39) PDK2

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
EP-3351536-B1 ORGANIC LIGHT-EMITTING DEVICE LG CHEMICAL LTD (KR) 2021-07-21 — — EP disclosed
EP-3351536-A1 ORGANIC LIGHT-EMITTING DEVICE LG Chem, Ltd. (KR) 2018-07-25 — — EP disclosed
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