SCHEMBL3202166

SCHEMBL3202166

COc1ccc(O)cc1[S+](c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.44
TUBB1 Q9H4B7 1/20 0.39
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
ALDH1A1 P00352 5/20 0.38
GAA P10253 1/20 0.38
KDM4E B2RXH2 4/20 0.38
HSD17B10 Q99714 4/20 0.38
HPGD P15428 2/20 0.38
USP2 O75604 1/20 0.38
GLA P06280 1/20 0.38
CYP3A4 P08684 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
AKR1B10 O60218 2/20 0.36
AKR1B1 P15121 2/20 0.36
BACE1 P56817 1/20 0.36
TTR P02766 1/20 0.36
NQO1 P15559 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
SCHEMBL3192396 0.86 MAOB (0.48) MAOBTUBB1CA1CA2TP53
SCHEMBL11743909 0.83 MAOB (0.42) MAOBTUBB1CA1CA2TP53
SCHEMBL3191770 0.82 ESR2 (0.33) MAOBALDH1A1GAAHSD17B10CYP3A4
SCHEMBL3203135 0.81 CA12 (0.48) CA1CA2ALDH1A1KDM4EHSD17B10
SCHEMBL3182131 0.81 ACHE (0.48) CA1CA2ALDH1A1GAAKDM4E
SCHEMBL2090403 0.77 CA1 (0.50) CA1CA2TP53TSHRALDH1A1
SCHEMBL31005134 0.77 CA1 (0.50) CA1CA2TP53TSHRALDH1A1
SCHEMBL3191983 0.77 ESR2 (0.44) TSHRALDH1A1GAAKDM4EHSD17B10
SCHEMBL3204433 0.76 ALOX5 (0.42) CA1CA2ALDH1A1GAAHSD17B10
SCHEMBL3203357 0.74 KIF11 (0.38) CA1CA2TP53TSHRALDH1A1

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