SCHEMBL394372

SCHEMBL394372

Nc1ccc(S(=O)(=O)OC(=O)CO)cc1.[Ti]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
ALDH1A1 P00352 2/20 0.44
NT5E P21589 1/20 0.44
LMNA P02545 2/20 0.42
MPO P05164 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
HTR6 P50406 1/20 0.42
F2 P00734 3/20 0.42
PRSS1 P07477 3/20 0.42
PRSS2 P07478 3/20 0.42
PRSS3 P35030 3/20 0.42
AGO2 Q9UKV8 2/20 0.42
CA1 P00915 5/20 0.41
CA2 P00918 5/20 0.41
CA12 O43570 4/20 0.41
CA9 Q16790 4/20 0.41
CA14 Q9ULX7 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
USP2 O75604 1/20 0.41

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
SCHEMBL27941248 0.84 TSHR (0.42) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL9728466 0.79 TSHR (0.41) TSHRALDH1A1HTR6CA1CA2
SCHEMBL28333967 0.79 TSHR (0.41) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL11037152 0.79 TSHR (0.49) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL8827511 0.79 TSHR (0.52) TSHRALDH1A1NT5ELMNAMPO
Methane SCHEMBL11511469 0.77 TSHR (0.50) TSHRALDH1A1NT5ELMNAMPO
Fluoride Ion SCHEMBL28590196 0.77 TSHR (0.39) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL27588753 0.76 CA1 (0.43) TSHRALDH1A1LMNACYP3A4CYP2C9
SCHEMBL31386568 0.76 TSHR (0.52) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL7607789 0.76 TSHR (0.52) TSHRALDH1A1NT5ELMNAMPO

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8883383-B2 Charge transport layer comprising fluoroacyl arylamine XEROX CORPORATION (US) 2014-11-11 US disclosed
US-20140141365-A1 Charge Transport Layer Comprising Fluoroacyl Arylamine XEROX CORPORATION (US) 2014-05-22 US disclosed
US-8481240-B2 Electrophotographic imaging member and method of making same XEROX CORPORATION (US) 2013-07-09 US disclosed
CN-101271285-B Photoreceptor device having a self-assembled patterned binder layer XEROX CORP 2012-11-07 CN disclosed
US-20120063818-A1 Electrophotographic Imaging Member and Method of Making Same U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL AGENT 2012-03-15 US disclosed
US-8101327-B2 Charge transport and overcoating layers formed by combining a film forming polycarbonate binder and a hole transporting hydroxy triarylamine compound; surface energy-reducing silicone is crosslinked with heat or ultraviolet radiation and the coating is dried to remove solvent XEROX CORPORATION (US) 2012-01-24 US disclosed
US-20080280220-A1 Electrophotographic imaging member and method of making same XEROX CORPORATION. 2008-11-13 US disclosed
CN-101271285-A Photoreceptor device having a self-assembled patterned binder layer XEROX CORP (US) 2008-09-24 CN disclosed
US-20080057424-A1 Overcoat for electrophotographic imaging member and methods of making and using same XEROX CORPORATION 2008-03-06 US disclosed
US-5846681-A Multilayer imaging member having improved substrate XEROX CORPORATION (US) 1998-12-08 US disclosed
US-5830613-A Electrophotographic imaging member having laminated layers XEROX CORPORATION (US) 1998-11-03 US disclosed