SCHEMBL2836727

SCHEMBL2836727

C=COBOCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
IDO1 P14902 1/20 0.40
AGXT P21549 1/20 0.39
ALOX15 P16050 1/20 0.35
ALDH1A1 P00352 3/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA9 Q16790 3/20 0.34
SLC6A2 P23975 2/20 0.34
SLC6A3 Q01959 2/20 0.34
LMNA P02545 1/20 0.34
CYP1A2 P05177 1/20 0.34
PTGS1 P23219 1/20 0.34
CYP2C19 P33261 1/20 0.34
PTGS2 P35354 1/20 0.34
HIF1A Q16665 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
CA7 P43166 1/20 0.34

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
SCHEMBL723193 0.80 TSHR (0.57) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL10988995 0.75 TSHR (0.46) TSHRIDO1AGXTALOX15ALDH1A1
SCHEMBL6132100 0.72 IDO1 (0.56) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL1162782 0.72 TSHR (0.48) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL7712856 0.72 TSHR (0.48) TSHRIDO1AGXTALDH1A1CA1
SCHEMBL145091 0.72 TSHR (0.52) TSHRIDO1AGXTALOX15ALDH1A1
SCHEMBL13033029 0.71 IDO1 (0.48) TSHRIDO1AGXTALDH1A1CA1
Ethylene SCHEMBL28940632 0.70 TSHR (0.50) TSHRIDO1AGXTALOX15ALDH1A1
SCHEMBL511745 0.68 TSHR (0.36) TSHRALOX15ALDH1A1L3MBTL1TDP1
SCHEMBL10383974 0.68 TSHR (0.48) TSHRIDO1AGXTALOX15ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014151284-A1 METHOD AND COMPOSITION FOR HYDRAULIC FRACTURING MEADWESTVACO CORPORATION (US) 2014-09-25 WO claimed
US-20100155297-A1 REMOVAL OF NITROGEN COMPOUNDS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2010-06-24 US claimed
EP-1893723-A1 REMOVAL OF NITROGEN COMPOUNDS JOHNSON MATTHEY PLC (GB) 2008-03-05 EP claimed
WO-2006136862-A1 REMOVAL OF NITROGEN COMPOUNDS JOHNSON MATTHEY PLC (GB) 2006-12-28 WO claimed
US-7083731-B2 Precious metal scavenging from a liquid medium with a functionalised polymer fiber JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2006-08-01 US claimed
US-6906135-B2 Graft copolymers JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2005-06-14 US claimed
EP-1332234-B1 PRECIOUS METAL SCAVENGING FROM A LIQUID MEDIUM WITH A FUNCTIONALISED POLYMER FIBER JOHNSON MATTHEY PLC (GB) 2004-12-29 EP claimed
EP-1337567-B1 GRAFT COPOLYMERS JOHNSON MATTHEY PLC (GB) 2004-09-15 EP claimed
US-20040034117-A1 Graft copolymers JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2004-02-19 US claimed
US-20040026329-A1 Precious metal scavenging from a liquid medium with a functionalised polymer fiber JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2004-02-12 US claimed
EP-1337567-A1 GRAFT COPOLYMERS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2003-08-27 EP claimed
EP-1332234-A1 PRECIOUS METAL SCAVENGING FROM A LIQUID MEDIUM WITH A FUNCTIONALISED POLYMER FIBER JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2003-08-06 EP claimed
WO-2002036648-A1 GRAFT COPOLYMERS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2002-05-10 WO claimed
WO-2002033135-A1 PRECIOUS METAL SCAVENGING FROM A LIQUID MEDIUM WITH A FUNCTIONALISED POLYMER FIBER JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2002-04-25 WO claimed
US-10479930-B2 Organic acid fracturing fluid composition KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2019-11-19 US disclosed
US-10435621-B2 Fracturing fluid composition containing an acrylamido-tert-butylsulfonate polymer KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2019-10-08 US disclosed
US-20190055463-A1 FRACTURING FLUID COMPOSITION CONTAINING AN ACRYLAMIDO-TERT-BUTYLSULFONATE POLYMER KING FAHD UNIVERSITY OF PETROLEUM AND MINERALS (SA) 2019-02-21 US disclosed
WO-2002036648-A1 GRAFT COPOLYMERS JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2002-05-10 WO disclosed
WO-2002033135-A1 PRECIOUS METAL SCAVENGING FROM A LIQUID MEDIUM WITH A FUNCTIONALISED POLYMER FIBER JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2002-04-25 WO disclosed
WO-2002011566-A2 GRAFT MODIFIED POLYMER, FIBROUS CATALYST AND USE THEREOF FOR SCAVENGING OXYGEN FROM A SEALED PACKAGE JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2002-02-14 WO disclosed