SCHEMBL20405290

SCHEMBL20405290

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

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 1/20 0.34
▸ ACMSD Q8TDX5 1/20 0.34
▸ PDK2 Q15119 11/20 0.34
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ SLC6A3 Q01959 1/20 0.33
▸ F9 P00740 1/20 0.32
▸ CA12 O43570 2/20 0.32
▸ CA1 P00915 2/20 0.32
▸ CA2 P00918 2/20 0.32
▸ CA9 Q16790 2/20 0.32
▸ PRSS1 P07477 2/20 0.31
▸ F2 P00734 1/20 0.31
▸ PLG P00747 1/20 0.31
▸ PPARG P37231 1/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ PLAU P00749 1/20 0.31
▸ PLAT P00750 1/20 0.31
▸ KLKB1 P03952 1/20 0.31
▸ PRSS2 P07478 1/20 0.31

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
SCHEMBL23655275 0.87 SLC6A2 (0.33) MCL1ACMSDPDK2SLC6A2SLC6A4
SCHEMBL20405039 0.84 MCL1 (0.32) MCL1ACMSDPDK2
SCHEMBL2965134 0.79 PDK2 (0.44) PDK2SLC6A2SLC6A4
SCHEMBL28283699 0.77 HPRT1 (0.41) MCL1ACMSDPDK2SLC6A2SLC6A4
SCHEMBL19153545 0.76 HDAC4 (0.41) MCL1ACMSDPDK2SLC6A2SLC6A4
SCHEMBL18821454 0.76 MEN1 (0.36) PDK2SLC6A2SLC6A4SLC6A3
SCHEMBL28744578 0.75 PDK2 (0.38) MCL1ACMSDPDK2SLC6A2SLC6A4
SCHEMBL24433016 0.75 PDK2 (0.38) PDK2SLC6A2SLC6A4SLC6A3
SCHEMBL20405120 0.75 PDK2 (0.39) MCL1ACMSDPDK2SLC6A2SLC6A4
SCHEMBL18386156 0.75 ENPP3 (0.37) MCL1ACMSDPDK2SLC6A2SLC6A4

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 3 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-3351537-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME LG Chem, Ltd. (KR) 2018-07-25 — — EP disclosed
EP-3351536-A1 ORGANIC LIGHT-EMITTING DEVICE LG Chem, Ltd. (KR) 2018-07-25 — — EP disclosed
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