SCHEMBL3206766

SCHEMBL3206766

CC(C)(C)OC(=O)COc1ccc([S+](c2ccccc2)c2ccccc2)cc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.43
HPGD P15428 3/20 0.43
POLB P06746 2/20 0.43
LMNA P02545 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ACLY P53396 3/20 0.42
MTNR1A P48039 2/20 0.38
MTNR1B P49286 2/20 0.38
KDM4E B2RXH2 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 2/20 0.36
PTPN1 P18031 1/20 0.36
TSHR P16473 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 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
SCHEMBL3203558 0.90 HPGD (0.43) MAPTHPGDPOLBLMNACYP2C9
SCHEMBL3195163 0.90 MAPT (0.44) MAPTHPGDPOLBLMNACYP2C9
SCHEMBL3203339 0.88 MAPT (0.43) MAPTHPGDPOLBLMNACYP2C9
SCHEMBL3193532 0.86 MTNR1A (0.45) MAPTHPGDPOLBLMNACYP2C9
SCHEMBL3191928 0.86 MAPT (0.42) MAPTHPGDPOLBLMNACYP2C9
SCHEMBL3203520 0.86 MTNR1A (0.47) MAPTHPGDPOLBCYP2C9CYP2C19
SCHEMBL3201103 0.86 MAPT (0.42) MAPTHPGDPOLBLMNACYP2C9
SCHEMBL3206974 0.85 MAPT (0.43) MAPTHPGDPOLBLMNACYP2C9
SCHEMBL3192462 0.81 MAPT (0.42) MAPTHPGDPOLBLMNACYP2C9
SCHEMBL133377 0.81 PTPN1 (0.51) MAPTHPGDPOLBLMNACYP2C9

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