SCHEMBL5502769

SCHEMBL5502769

O=S(=O)(C1=CCCC=C1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.48
TSHR P16473 3/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 2/20 0.35
CA13 Q8N1Q1 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CA3 P07451 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
PLA2G7 Q13093 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL13909328 0.89 HTR6 (0.45) HTR6TSHRCA12CA1CA2
SCHEMBL15102743 0.81 GAA (0.52) CA12CA1CA2CA7ALDH1A1
SCHEMBL10597398 0.81 ALDH1A1 (0.33) ALDH1A1
SCHEMBL24284446 0.80 GAA (0.31) HTR6GAAMCOLN3
SCHEMBL25873077 0.79 TDP1 (0.38) HTR6TSHRCA12CA1CA2
SCHEMBL21388034 0.78 TDP1 (0.37) HTR6TSHRCA12CA1CA2
SCHEMBL19648485 0.77
SCHEMBL22137262 0.77
SCHEMBL10824645 0.74 MMP3 (0.40) CA12CA1CA2CA9PKM
SCHEMBL7117901 0.73 KEAP1 (0.48) CA12CA1CA2ALDH1A1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101031554-A Benzoxazine and quinoxaline derivatives and uses HOFFMANN LA ROCHE (CH) 2007-09-05 CN claimed
US-20040229009-A1 Polyamide fiber substrate having stain resistance, composition and method TRI-TEXCO INC. (CA) 2004-11-18 US claimed
US-20020137415-A1 Polyamide fiber substrate having stain resistance, composition and method TRI-TEXCO INC. (CA) 2002-09-26 US claimed
EP-4056627-B1 POLYIMIDE-BASED POLYMER, POSITIVE PHOTOSENSITIVE RESIN COMPOSITION, NEGATIVE PHOTOSENSITIVE RESIN COMPOSTION, PATTERNING METHOD, METHOD FOR FORMING CURED FILM, INTERLAYER INSULATING FILM, SURFACE PROTECTIVE FILM, AND ELECTRONIC COMPONENT SHINETSU CHEMICAL CO (JP) 2023-08-23 EP disclosed
EP-3974904-A1 PHOTOSENSITIVE RESIN COMPOSITION, PATTERNING PROCESS, METHOD FOR FORMING CURED FILM, INTERLAYER INSULATION FILM, SURFACE PROTECTIVE FILM, AND ELECTRONIC COMPONENT Shin-Etsu Chemical Co., Ltd. (JP) 2022-03-30 EP disclosed
EP-3486991-A1 ELECTROLYTE ADDITIVE FOR LITHIUM BATTERY, ORGANIC ELECTROLYTE SOLUTION INCLUDING THE SAME, AND LITHIUM BATTERY INCLUDING THE SAME Samsung Electronics Co., Ltd. (KR) 2019-05-22 EP disclosed
WO-2017174545-A1 PHOTOCURABLE POLYMERS, PHOTOCURABLE POLYMER COMPOSITIONS AND LITHOGRAPHIC PROCESSES INCLUDING THE SAME SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2017-10-12 WO disclosed
EP-3010052-A1 DELAYED FLUORESCENCE COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND DISPLAY DEVICE USING THE SAME LG Display Co., Ltd. (KR) 2016-04-20 EP disclosed
WO-2016043024-A1 CURABLE COMPOSITION AND OPTICAL ELEMENT OBTAINED USING SAME 株式会社ダイセル 2016-03-24 WO disclosed
CN-100540546-C Be used to regulate 5-HT6 acceptor, 5-HT2A acceptor or both aryl sulfonyl benzos two alkane HOFFMANN LA ROCHE (CH) 2009-09-16 CN disclosed
CN-101031554-A Benzoxazine and quinoxaline derivatives and uses HOFFMANN LA ROCHE (CH) 2007-09-05 CN disclosed
CN-1960983-A Arylsulfonyl benzodioxanes useful for modulation the 5-HT6 receptor, the 5-HT2areceptor or both HOFFMANN LA ROCHE (CH) 2007-05-09 CN disclosed
EP-1748995-A1 ARYLSULFONYL BENZODIOXANES USEFUL FOR MODULATION THE 5-HT6 RECEPTOR, THE 5-HT2ARECEPTOR OR BOTH F. Hoffmann-La Roche AG (CH) 2007-02-07 EP disclosed
WO-2005105776-A1 ARYLSULFONYL BENZODIOXANES USEFUL FOR MODULATION THE 5-HT6 RECEPTOR, THE 5-HT2ARECEPTOR OR BOTH F. HOFFMANN-LA ROCHE AG (CH) 2005-11-10 WO disclosed