SCHEMBL3199694

SCHEMBL3199694

CC(C)(C)OC(=O)COc1cccc(OCC(=O)OC(C)(C)C)c1S(OS(=O)(=O)c1ccc(F)cc1F)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 5/20 0.36
MAPT P10636 3/20 0.36
POLB P06746 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
ABCC9 O60706 1/20 0.33
ABCC8 Q09428 1/20 0.33
KCNJ11 Q14654 1/20 0.33
KCNJ8 Q15842 1/20 0.33

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
SCHEMBL3200070 0.93 MAPT (0.42) ACLYMAPTPOLBCYP2C9HPGD
SCHEMBL3192050 0.88 ACLY (0.36) ACLYMAPTPOLBCYP2C9HPGD
SCHEMBL3189163 0.88 ACLY (0.36) ACLYMAPTPOLBCYP2C9HPGD
SCHEMBL3200864 0.88 PSEN1 (0.38) ACLYMAPTPOLBCYP2C9HPGD
SCHEMBL3181550 0.88 MAPT (0.40) ACLYMAPTPOLBCYP2C9HPGD
SCHEMBL3192068 0.87 PSEN1 (0.44) MAPTPOLBCYP2C9HPGDCYP2C19
SCHEMBL3182795 0.86 PSEN1 (0.39) ACLYMAPTPOLBCYP2C9HPGD
SCHEMBL3190169 0.86 ACLY (0.36) ACLYMAPTPOLBCYP2C9HPGD
SCHEMBL3201056 0.83 PSEN1 (0.41) ACLYCYP2C9HPGDCYP2C19PSEN1
SCHEMBL3201825 0.83 ACLY (0.39) ACLYMAPTPOLBCYP2C9HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8206888-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2012-06-26 US disclosed
US-20100028800-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR CORPORATION (JP) 2010-02-04 US disclosed
EP-1953593-A1 RADIATION-SENSITIVE RESIN COMPOSITION JSR Corporation (JP) 2008-08-06 EP disclosed
US-7060414-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2006-06-13 US disclosed
US-20050158657-A1 Radiation-sensitive resin composition SUZUKI AKI (JP) 2005-07-21 US disclosed
US-6899989-B2 Radiation-sensitive resin composition JSR CORPORATION (JP) 2005-05-31 US disclosed