SCHEMBL3193377

SCHEMBL3193377

CC(C)(C)Oc1cccc(OC(C)(C)C)c1S(OS(=O)(=O)c1ccc(C(F)(F)F)cc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 9/20 0.40
HSD17B3 P37058 1/20 0.38
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
PTGS2 P35354 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.34
CYP3A4 P08684 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
NR1H3 Q13133 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
CYP2D6 P10635 1/20 0.33
AR P10275 1/20 0.33
MEN1 O00255 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 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
SCHEMBL3200904 0.90 HSD11B1 (0.38) HSD11B1HSD17B3BCHEACHEPTGS2
SCHEMBL3197754 0.89 KMT2A (0.37) HSD11B1HSD17B3PTGS2ALDH1A1MEN1
SCHEMBL3191640 0.85 CYP3A4 (0.35) HSD11B1CYP3A4CYP2C9CYP2C19NR1H3
SCHEMBL3191828 0.85 HTR6 (0.33) HSD11B1CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL3183484 0.85 ALDH1A1 (0.34) HSD11B1CYP3A4CYP2C9CYP2C19NR1H3
SCHEMBL3132787 0.84 HSD11B1 (0.43) HSD11B1PTGS2PTGES2CA1CA2
SCHEMBL3182063 0.82 HSD11B1 (0.38) HSD11B1BCHEACHEPTGS2PTGES2
SCHEMBL3203657 0.82 HSD11B1 (0.40) HSD11B1BCHEACHEPTGS2CA1
SCHEMBL3188782 0.82 PSEN1 (0.42) HSD11B1CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL3203865 0.81 HSD11B1 (0.37) HSD11B1HSD17B3PTGS2CA1CA2

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