SCHEMBL325805

SCHEMBL325805

CCC(O)COCC(O)CC

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
HSD17B10 Q99714 1/20 0.43
TSHR P16473 3/20 0.40
USP2 O75604 1/20 0.39
HTT P42858 2/20 0.38
TDP1 Q9NUW8 1/20 0.36
LPAR5 Q9H1C0 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA7 P43166 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
HPGD P15428 1/20 0.30

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
Water SCHEMBL27734809 0.97 KDM4E (0.50) KDM4EHSD17B10TSHRUSP2HTT
SCHEMBL13108264 0.89 KDM4E (0.44) KDM4EHSD17B10TSHRUSP2HTT
SCHEMBL10469575 0.89 KDM4E (0.44) KDM4EHSD17B10TSHRUSP2HTT
SCHEMBL20041680 0.89 HSD17B10 (0.61) KDM4EHSD17B10TSHRUSP2HTT
SCHEMBL14667423 0.89 KDM4E (0.44) KDM4EHSD17B10TSHRUSP2HTT
SCHEMBL14468244 0.89 KDM4E (0.44) KDM4EHSD17B10TSHRUSP2HTT
SCHEMBL1709058 0.89 USP2 (0.54) KDM4EHSD17B10TSHRUSP2HTT
SCHEMBL13838795 0.88
SCHEMBL14444694 0.88 KDM4E (0.42) KDM4EHSD17B10TSHRUSP2HTT
SCHEMBL12011139 0.88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103260617-B Comprise the pharmaceutical preparation of NSAID and cyclodextrin 雷克特本克斯尔医疗保健国际有限公司 2016-08-24 CN claimed
CN-102282301-B Electrospinning of ptfe with high viscosity materials ZEUS IND PRODUCTS INC 2014-07-30 CN claimed
CN-103260617-A Novel pharmaceutical formulation comprising NSAID and cyclodextrin RECKITT BENCKISER HEALTHCARE INT LTD 2013-08-21 CN claimed
CN-102718455-B Cement based capillary crystalline high-performance waterproofing powder and application thereof ANHUI LANGKAIQI BUILDING MATERIALS CO LTD 2013-07-24 CN claimed
CN-102718455-A Cement based capillary crystalline high-performance waterproofing powder and application thereof ANHUI LANGKAIQI BUILDING MATERIALS CO LTD 2012-10-10 CN claimed
CN-102282301-A ELECTROSPINNING OF PTFE WITH HIGH VISCOSITY MATERIALS 2011-12-14 CN claimed
US-6686331-B2 PRINCIPAL SOLVENTS, ESPECIALLY MONO AND DIOL PRINCIPAL SOLVENTS, HAVING A SPECIFIED CLOGP VALUE, SPECIFIED TYPES OF SOFTENERS SUCH AS VARISOFT?, WATER AND OPTIONAL ADDITIVES; PREMIX THE PROCTER & GAMBLE COMPANY 2004-02-03 US claimed
US-20030153483-A1 Concentrated, stable fabric softening composition TRINH TOAN (US) 2003-08-14 US claimed
CN-1110541-C Concentrated water-dispersible stable fiber softener compositions PROCTER & GAMBLE (US) 2003-06-04 CN claimed
CN-1098350-C Fabric softening compound/composition PROCTER & GAMBLE (US) 2003-01-08 CN claimed
WO-1998017756-A1 CONCENTRATED FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1998-04-30 WO claimed
WO-1997034972-A1 FABRIC SOFTENING COMPOUND/COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1997-09-25 WO claimed
US-5646093-A Modified polygalactomannans as oil field shale inhibitors RHONE-POULENC INC. (US) 1997-07-08 US claimed
CN-1144813-A Hypoallergenic coating composition for latex rubber gloves WITCO CORP (US) 1997-03-12 CN claimed
WO-1997003170-A1 CONCENTRATED, WATER DISPERSIBLE, STABLE, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO claimed
WO-1997003169-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO claimed
EP-0578759-A1 BIODEGRADABLE COMPOSITIONS COMPRISING STARCH DERIVATIVES PARKE, DAVIS & COMPANY (US) 1994-01-19 EP claimed
WO-1993020141-A1 BIODEGRADABLE STARCH DERIVATIVE COMPOSITIONS PARKE-DAVIS & COMPANY (US) 1993-10-14 WO claimed
US-5233032-A For fracturing subterranean formations STEIN, HALL & CO., INC. (US) 1993-08-03 US claimed
WO-1992016583-A1 BIODEGRADABLE COMPOSITIONS COMPRISING STARCH DERIVATIVES PARKE, DAVIS & COMPANY (US) 1992-10-01 WO claimed