SCHEMBL137897

SCHEMBL137897

O=[N+]([O-])c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.71
KMT2A Q03164 7/20 0.71
LMNA P02545 6/20 0.71
SMN1; SMN2 Q16637 4/20 0.71
HTT P42858 3/20 0.71
PKM P14618 2/20 0.71
NPC1 O15118 1/20 0.71
MAPK1 P28482 1/20 0.71
TP53 P04637 1/20 0.71
MEN1 O00255 5/20 0.67
NPSR1 Q6W5P4 4/20 0.67
TDP1 Q9NUW8 4/20 0.67
HPGD P15428 3/20 0.67
GAA P10253 3/20 0.67
HSP90AA1 P07900 2/20 0.67
ALDH1A1 P00352 3/20 0.57
XBP1 P17861 1/20 0.57
RECQL P46063 1/20 0.57
HKDC1 Q2TB90 1/20 0.57
PTPN1 P18031 1/20 0.57

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
SCHEMBL29405540 1.00 MAPT (0.71) MAPTKMT2ALMNASMN1; SMN2HTT
SCHEMBL11366224 0.98 MAPT (0.69) MAPTKMT2ALMNASMN1; SMN2HTT
SCHEMBL30662168 0.89 PDK1 (0.64) MAPTKMT2ALMNASMN1; SMN2HTT
SCHEMBL24118868 0.86 KMT2A (0.57) MAPTKMT2ALMNASMN1; SMN2HTT
SCHEMBL10781795 0.83 MAPT (0.60) MAPTKMT2ALMNASMN1; SMN2HTT
SCHEMBL13355661 0.83 MAPT (0.66) MAPTKMT2ALMNASMN1; SMN2HTT
SCHEMBL22558176 0.81 TXNRD1 (0.51) MAPTKMT2ALMNASMN1; SMN2HTT
SCHEMBL10752315 0.81 MAPT (0.63) MAPTKMT2ALMNASMN1; SMN2HTT
SCHEMBL2238611 0.81 MAPT (0.64) MAPTKMT2ALMNASMN1; SMN2HTT
SCHEMBL11341135 0.80 MMP13 (0.59) MAPTKMT2ALMNASMN1; SMN2HTT

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 1257 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110698734-B Nano-selenium heat-conducting and insulating rubber material and preparation method and application thereof 华南理工大学 2021-08-27 CN claimed
CN-111205526-A Corrosion-resistant wear-resistant nitrile rubber blend and preparation method and application thereof 湖南昶力轨道交通设备有限公司 2020-05-29 CN claimed
US-10655015-B2 Tire crumb-based bitumen polymer for producing a lower viscosity asphalt with improved tolerance to high temperatures Argopro Group LLC (US) 2020-05-19 US claimed
US-20200095424-A1 TIRE CRUMB-BASED BITUMEN POLYMER FOR PRODUCING A LOWER VISCOSITY ASPHALT WITH IMPROVED TOLERANCE TO HIGH TEMPERATURES Argopro Group LLC 2020-03-26 US claimed
CN-110698734-A Nano-selenium heat-conducting and insulating rubber material and preparation method and application thereof 华南理工大学 2020-01-17 CN claimed
US-8273810-B2 Polyisoprene articles and process for making the same ALLEGIANCE CORPORATION (US) 2012-09-25 US claimed
US-20110203596-A1 POLYISOPRENE ARTICLES AND PROCESS FOR MAKING THE SAME ALLEGIANCE CORPORATION (US) 2011-08-25 US claimed
JP-2010536987-A 2010-12-02 JP claimed
EP-2250218-A1 TIRE AND CROSSLINKABLE ELASTOMERIC COMPOSITION Pirelli Tyre S.P.A. (IT) 2010-11-17 EP claimed
EP-2183303-A1 COMPOUNDING FORMULATIONS FOR PRODUCING ARTICLES FROM GUAYULE NATURAL RUBBER Yulex Corporation (US) 2010-05-12 EP claimed
WO-2009107151-A1 TIRE AND CROSSLINKABLE ELASTOMERIC COMPOSITION PIRELLI TYRE S.P.A. (IT) 2009-09-03 WO claimed
US-20090199945-A1 Tire and Crosslinkable Elastomeric Composition POLITECNICO DI MILANO (50%) (IT) 2009-08-13 US claimed
WO-2009025675-A1 COMPOUNDING FORMULATIONS FOR PRODUCING ARTICLES FROM GUAYULE NATURAL RUBBER YULEX CORPORATION (US) 2009-02-26 WO claimed
US-20090054595-A1 Compounding Formulations for Producing Articles from Guayule Natural Rubber YULEX CORPORATION 2009-02-26 US claimed
EP-1991431-A1 TIRE AND CROSSLINKABLE ELASTOMERIC COMPOSITION PIRELLI TYRE S.p.A. (IT) 2008-11-19 EP claimed
WO-2007098784-A1 TIRE AND CROSSLINKABLE ELASTOMERIC COMPOSITION PIRELLI TYRE S.P.A. (IT) 2007-09-07 WO claimed
US-20020061979-A1 VULCANIZABLE EPDM CONTAINING RUBBER COMPOSITION DEGUSSA AG (DE) 2002-05-23 US claimed
EP-0562750-B1 Rubber composition BRIDGESTONE CORP (JP) 1997-10-01 EP claimed
US-5391635-A Consists of styrene-butadiene copolymer, aromatic or vegetable oils as softening agent, thiuram compound, dithiocarbamate compound, benzothiazole and guanidine vulcunization accelerators BRIDGESTONE CORPORATION (JP) 1995-02-21 US claimed
EP-0562750-A2 Rubber composition BRIDGESTONE CORPORATION (JP) 1993-09-29 EP claimed