SCHEMBL409776

SCHEMBL409776

Sc1ccccc1-c1nccs1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.53
ADORA2A P29274 2/20 0.45
ADORA1 P30542 2/20 0.45
RAB9A P51151 2/20 0.43
CYP2A6 P11509 1/20 0.43
ADRA1A P35348 3/20 0.42
ADRA1D P25100 2/20 0.42
ADRA1B P35368 1/20 0.42
ADRA2A P08913 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.39
HSP90AA1 P07900 1/20 0.38
METAP1 P53582 1/20 0.38
CASP6 P55212 1/20 0.36
ADRB2 P07550 1/20 0.36
NPC1 O15118 1/20 0.36
TGFBR1 P36897 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
IDO1 P14902 1/20 0.35
GRM5 P41594 1/20 0.35
ADORA3 P0DMS8 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
SCHEMBL7044949 0.98 PDPK1 (0.52) PDPK1ADORA2AADORA1RAB9ACYP2A6
SCHEMBL7624882 0.98 PDPK1 (0.52) PDPK1ADORA2AADORA1RAB9ACYP2A6
SCHEMBL2269191 0.98 PDPK1 (0.52) PDPK1ADORA2AADORA1RAB9ACYP2A6
SCHEMBL5692672 0.85 PDPK1 (0.64) PDPK1ADORA2AADORA1RAB9ACYP2A6
SCHEMBL1951149 0.83 PDPK1 (0.61) PDPK1ADORA2AADORA1RAB9ACYP2A6
SCHEMBL24181671 0.82 PDPK1 (0.43) PDPK1ADORA2AADORA1RAB9ACYP2A6
SCHEMBL8567274 0.78 PDPK1 (0.55) PDPK1ADORA2AADORA1RAB9ACYP2A6
SCHEMBL26259375 0.77 PDPK1 (0.59) PDPK1ADORA2AADORA1RAB9ACYP2A6
SCHEMBL26259560 0.77 PDPK1 (0.54) PDPK1ADORA2AADORA1RAB9ACYP2A6
SCHEMBL10977585 0.76 PDPK1 (0.53) PDPK1ADORA2AADORA1RAB9ACYP2A6

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 348 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11545349-B2 Matrix-assisted laser desorption/ionization mass spectrometry method BIONEER CORPORATION (KR) 2023-01-03 US claimed
CN-113684007-A Cooling medium and preparation method and application thereof 中国石油化工股份有限公司 2021-11-23 CN claimed
CN-112294975-A Contact allergen reagent combination and application thereof 上海市皮肤病医院 2021-02-02 CN claimed
US-20190279853-A1 MATRIX-ASSISTED LASER DESORPTION/IONIZATION MASS SPECTROMETRY METHOD BIONEER CORPORATION (KR) 2019-09-12 US claimed
EP-3537143-A1 MATRIX-ASSISTED LASER DESORPTION/IONIZATION MASS SPECTROMETRY METHOD Bioneer Corporation (KR) 2019-09-11 EP claimed
US-20180362214-A1 LINER WITH ANTI-MICROBIAL AND/OR ANTI-FUNGAL AGENT BROADWAY HOLDINGS IV, LLC 2018-12-20 US claimed
CN-106700130-A Composite modified melamine cyanurate fire retardant and preparation method and application of fire retardant 湖州利鹏新材料科技有限公司 2017-05-24 CN claimed
EP-2324087-A2 COATINGS AND SURFACE TREATMENTS HAVING ACTIVE ENZYMES AND PEPTIDES McDaniel, Steven C. (US) 2011-05-25 EP claimed
US-20100233146-A1 Coatings and Surface Treatments Having Active Enzymes and Peptides REACTIVE SURFACES, LTD. (US) 2010-09-16 US claimed
US-20100175796-A1 Anti fungal and anti-microbial protection for storage items and protective covers BROADWAY HOLDINGS IV, LLC 2010-07-15 US claimed
EP-0618911-A1 PROCESS FOR PRODUCING BENZOTHIAZOLYL-2-SULPHENAMIDES Akzo Nobel N.V. (NL) 1994-10-12 EP claimed
WO-1993013084-A1 PROCESS FOR PRODUCING BENZOTHIAZOLYL-2-SULPHENAMIDES AKZO NOBEL N.V. (NL) 1993-07-08 WO claimed
EP-0420453-A1 Sulphur coupled hydrocarbyl derived mercaptobenzothiazole adducts as multifunctional antiwear additives and compositions containing same MOBIL OIL CORPORATION (US) 1991-04-03 EP claimed
EP-0402430-A1 AQUEOUS SOLUTIONS OF OLEOPHILIC COMPOUNDS. KODAK LTD (GB) 1990-12-19 EP claimed
WO-1990003600-A1 AQUEOUS SOLUTIONS OF OLEOPHILIC COMPOUNDS KODAK LIMITED (GB) 1990-04-05 WO claimed
EP-0314663-A1 Process for the preparation of benzothiazole-2-sulphenamides MONSANTO EUROPE S.A./N.V. (BE) 1989-05-03 EP claimed
EP-0279381-A2 Magnetic recording medium Hitachi Maxell Ltd. (JP) 1988-08-24 EP claimed
EP-0259254-A1 Phenolic benzothiazole derivatives and their use as corrosion inhibitors CIBA-GEIGY AG (CH) 1988-03-09 EP claimed
US-4388484-A Oil field mats YORK GERALD O 1983-06-14 US claimed
US-4371631-A ASBESTOS FREE, RUBBERS, GLASS FIBERS MANVILLE SERVICE CORPORATION (US) 1983-02-01 US claimed