SCHEMBL12767605

SCHEMBL12767605

CC(C)c1cccc(OC2=C(Oc3cccc(C(C)C)c3)C(=O)c3ccccc3C2=O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS1 P23219 1/20 0.49
▸ NSD2 O96028 1/20 0.46
▸ HSP90AA1 P07900 1/20 0.46
▸ HKDC1 Q2TB90 1/20 0.46
▸ TLR9 Q9NR96 1/20 0.46
▸ HDAC4 P56524 2/20 0.45
▸ HDAC8 Q9BY41 2/20 0.45
▸ CYP2D6 P10635 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ CASP1 P29466 1/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ ALDH1A1 P00352 4/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ HPGD P15428 3/20 0.43
▸ TP53 P04637 2/20 0.43
▸ CYP3A4 P08684 2/20 0.43
▸ ALOX15 P16050 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43

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
SCHEMBL30345552 0.81 PTGS1 (0.56) PTGS1HDAC4HDAC8CYP2D6MEN1
SCHEMBL11063307 0.81 PTGS1 (0.56) PTGS1HDAC4HDAC8CYP2D6MEN1
SCHEMBL12767607 0.80 NSD2 (0.55) NSD2HSP90AA1HKDC1TLR9CYP2D6
SCHEMBL765113 0.80 PTGS1 (0.66) PTGS1CYP2D6MEN1KMT2ACASP1
SCHEMBL30358257 0.80 PTGS1 (0.66) PTGS1CYP2D6MEN1KMT2ACASP1
SCHEMBL15849013 0.79 PTGS1 (0.55) PTGS1HDAC4HDAC8CYP2D6MEN1
SCHEMBL19409298 0.79 TDP1 (0.54) PTGS1NSD2HSP90AA1HKDC1TLR9
SCHEMBL123764 0.77 PTGS1 (0.58) PTGS1HDAC4HDAC8CYP2D6MEN1
SCHEMBL26473527 0.77 HDAC4 (0.41) PTGS1HDAC4HDAC8CASP1
SCHEMBL14665631 0.77 HTT (0.60) PTGS1CYP2D6MEN1KMT2ACASP1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE42189-E1 Single-layer type electrophotosensitive material and image forming apparatus using the same KYOCERA MITA CORPORATION (JP) 2011-03-01 — — US disclosed
US-RE42189-E1 Single-layer type electrophotosensitive material and image forming apparatus using the same KYOCERA MITA CORPORATION (JP) 2011-03-01 — — US disclosed
US-20080286673-A1 Single layer type electrophotographic photoconductor and image forming device KYOCERA MITA CORPORATION 2008-11-20 — — US disclosed
US-20080286673-A1 Single layer type electrophotographic photoconductor and image forming device KYOCERA MITA CORPORATION 2008-11-20 — — US disclosed
US-7416825-B2 Single layer type electrophotographic photoconductor and image forming device KYOCERA MITA CORPORATION (JP) 2008-08-26 — — US disclosed
US-7416825-B2 Single layer type electrophotographic photoconductor and image forming device KYOCERA MITA CORPORATION (JP) 2008-08-26 — — US disclosed
US-RE39516-E1 Single-layer type electrophotosensitive material and image forming apparatus using the same KYOCERA MITA CORPORATION (JP) 2007-03-13 — — US disclosed
US-RE39516-E1 Single-layer type electrophotosensitive material and image forming apparatus using the same KYOCERA MITA CORPORATION (JP) 2007-03-13 — — US disclosed
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