SCHEMBL13026291

SCHEMBL13026291

COc1ccc(-c2c3ccccc3c(-c3cc4c(c5c6c(ccc35)C(C)(C)c3ccccc3-6)-c3ccccc3C4(C)C)c3ccccc23)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 1/20 0.37
▸ ABL1 P00519 1/20 0.37
▸ ABCB1 P08183 1/20 0.37
▸ BCR P11274 1/20 0.37
▸ ACHE P22303 1/20 0.36
▸ PDK2 Q15119 2/20 0.36
▸ ALOX5 P09917 1/20 0.34
▸ HDAC4 P56524 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ ACACA Q13085 1/20 0.34
▸ MAOB P27338 2/20 0.33
▸ PTPN1 P18031 1/20 0.33
▸ ENPP1 P22413 1/20 0.33
▸ PDE4D Q08499 1/20 0.32
▸ GPR84 Q9NQS5 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL10009845 0.90 ABL1 (0.42) PGRABL1ABCB1BCRACHE
SCHEMBL13026287 0.86 ACHE (0.35) PGRACHEPDK2KDM4E
SCHEMBL12952515 0.85 ABL1 (0.45) PGRABL1ABCB1BCRACHE
SCHEMBL13150216 0.85 PDK2 (0.40) PGRABL1ABCB1BCRACHE
SCHEMBL13026273 0.83 KIF11 (0.32) MAOB
SCHEMBL13026295 0.83 PGR (0.38) PGRPDK2MAOBALDH1A1
SCHEMBL13025512 0.83 — —
SCHEMBL13026294 0.81 KDM4E (0.33) HDAC4KDM4E
SCHEMBL13025511 0.81 PDK2 (0.36) PDK2PTPN1TDP1
SCHEMBL13487120 0.81 PDK2 (0.40) PGRABL1ABCB1BCRACHE

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-2010151006-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME DOW ADVANCED DISPLAY MATERIALS, LTD. (KR) 2010-12-29 — — WO disclosed
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