SCHEMBL3183442

SCHEMBL3183442

CC(C)(C)OC(=O)COc1cc(O)cc([S+](c2ccccc2)c2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
LMNA P02545 1/20 0.51
HPGD P15428 2/20 0.46
POLB P06746 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PTPN1 P18031 2/20 0.42
PSEN1 P49768 2/20 0.40
PSEN2 P49810 2/20 0.40
APH1B Q8WW43 2/20 0.40
NCSTN Q92542 2/20 0.40
APH1A Q96BI3 2/20 0.40
PSENEN Q9NZ42 2/20 0.40
ACLY P53396 1/20 0.37
CTSK P43235 1/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
ALPL P05186 1/20 0.36
ALPI P09923 1/20 0.36

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
SCHEMBL3206660 0.93 MAPT (0.48) MAPTLMNAHPGDPOLBCYP2C9
SCHEMBL3192922 0.89 MAPT (0.45) MAPTLMNAHPGDPOLBCYP2C9
SCHEMBL3193987 0.89 MAPT (0.45) MAPTLMNAHPGDPOLBCYP2C9
SCHEMBL3192511 0.89 POLB (0.45) MAPTLMNAHPGDPOLBCYP2C9
SCHEMBL8318359 0.87 MAPT (0.45) MAPTLMNAHPGDPOLBCYP2C9
SCHEMBL8323320 0.85 PTPN1 (0.51) MAPTLMNAHPGDPOLBCYP2C9
SCHEMBL133377 0.85 PTPN1 (0.51) MAPTLMNAHPGDPOLBCYP2C9
SCHEMBL3190437 0.84 MAPT (0.50) MAPTLMNAHPGDPOLBCYP2C9
SCHEMBL8319923 0.82 PSEN1 (0.44) MAPTLMNAHPGDPOLBCYP2C9
SCHEMBL3194034 0.82 HPGD (0.54) MAPTLMNAHPGDPOLBCYP2C9

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 7 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
US-20020090569-A1 Radiation-sensitive resin composition JSR CORPORATION (JP) 2002-07-11 US disclosed