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SCHEMBL14536648

SCHEMBL14536648

CCOP(=O)(Cc1ccc(-c2ccc3c(c2)C(C)(C)c2cc(-c4ccc5c(c4)C(C)(C)c4cc(-c6ccc(CP(=O)(OCC)OCC)cc6)ccc4-5)ccc2-3)cc1)OCC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 4/20 0.40
▸ CCNT1 O60563 5/20 0.39
▸ CDK9 P50750 5/20 0.39
▸ NPY5R Q15761 1/20 0.35
▸ PDK2 Q15119 2/20 0.34
▸ MAPT P10636 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ PTK2 Q05397 1/20 0.31
▸ TLR8 Q9NR97 1/20 0.31
▸ TLR7 Q9NYK1 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
SCHEMBL13780008 0.97 CCNT1 (0.40) HDAC1CCNT1CDK9NPY5RPDK2
SCHEMBL13780011 0.97 HDAC1 (0.39) HDAC1CCNT1CDK9NPY5RPDK2
SCHEMBL3298700 0.88 CCNT1 (0.37) HDAC1CCNT1CDK9NPY5RMAPT
SCHEMBL13780017 0.88 HDAC1 (0.36) HDAC1CCNT1CDK9PDK2
SCHEMBL13780012 0.87 CCNT1 (0.34) HDAC1CCNT1CDK9NPY5R
SCHEMBL14536807 0.86 NPY5R (0.36) HDAC1CCNT1CDK9NPY5RMAPT
SCHEMBL13779999 0.84 HDAC1 (0.32) HDAC1CCNT1CDK9PDK2
SCHEMBL2493713 0.82 TSHR (0.44) HDAC1CCNT1CDK9NPY5RMAPT
SCHEMBL13242789 0.81 CCNT1 (0.33) HDAC1CCNT1CDK9NPY5RMAPT
SCHEMBL17485921 0.79 HDAC1 (0.40) HDAC1CCNT1CDK9NPY5RMAPT

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-2007061218-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND DISPLAY DEVICE USING THE SAME GRACEL DISPLAY INC. (KR) 2007-05-31 — — WO disclosed
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