SCHEMBL3192177

SCHEMBL3192177

COc1ccc(OC(C)(C)C)c([S+](c2ccccc2)c2ccccc2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2A6 P11509 1/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 4/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
GAA P10253 2/20 0.35
LMNA P02545 3/20 0.35
ALOX12 P18054 1/20 0.35
CA4 P22748 1/20 0.34
LTA4H P09960 1/20 0.34
MAPT P10636 2/20 0.34

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
SCHEMBL3193129 0.91 KIF11 (0.40)
SCHEMBL3203357 0.88 KIF11 (0.38) CA12CA1CA2CA7CA9
SCHEMBL3201005 0.88 CYP1A2 (0.38) CA12CA1CA2CA7CA9
SCHEMBL3203135 0.85 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL3181514 0.81 ACHE (0.32) CYP1A2MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL3191770 0.80 ESR2 (0.33) ALDH1A1GAALMNA
SCHEMBL3182804 0.79 KIF11 (0.38) CA12CA1CA2CA7CA9
SCHEMBL3182794 0.78 KIF11 (0.40)
SCHEMBL3190064 0.77 MAPT (0.43) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL3190469 0.77 POLB (0.43) SMN1; SMN2GAALMNAMAPTKDM4E

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