SCHEMBL187423

SCHEMBL187423

CC(C)OC(=O)N=NC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
HCAR2 Q8TDS4 1/20 0.38
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
CA12 O43570 3/20 0.30
CA1 P00915 3/20 0.30
CA2 P00918 3/20 0.30
CA7 P43166 3/20 0.30
CA9 Q16790 3/20 0.30
CA14 Q9ULX7 3/20 0.30
LMNA P02545 2/20 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
SCHEMBL23884961 1.00 TSHR (0.42) TSHRHCAR2GAASMN1; SMN2PDCD1
SCHEMBL3787432 1.00 TSHR (0.42) TSHRHCAR2GAASMN1; SMN2PDCD1
SCHEMBL25204408 1.00 TSHR (0.42) TSHRHCAR2GAASMN1; SMN2PDCD1
Hydrogen Peroxide SCHEMBL27935318 0.92 TSHR (0.48) TSHRHCAR2GAASMN1; SMN2PDCD1
SCHEMBL27539518 0.89 TSHR (0.50) TSHRHCAR2PDCD1CD274CA12
SCHEMBL19257 0.89 TSHR (0.50) TSHRHCAR2PDCD1CD274CA12
SCHEMBL444245 0.89 TSHR (0.50) TSHRHCAR2PDCD1CD274CA12
SCHEMBL19256 0.89 TSHR (0.50) TSHRHCAR2PDCD1CD274CA12
Bicarbonate SCHEMBL2348361 0.87 TSHR (0.43) TSHRHCAR2PDCD1CD274CA12
Benzene SCHEMBL27815751 0.87 TSHR (0.43) TSHRHCAR2GAASMN1; SMN2PDCD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118290424-A Preparation method of aminopyrimidino pyrazole/pyrrole derivative based on double decomposition reaction 四川大学华西医院 2024-07-05 CN claimed
CN-118164991-A Preparation method of aminopyrimidino pyrazole/pyrrole derivative 四川大学华西医院 2024-06-11 CN claimed
CN-117089106-A Preparation process of high-foaming-ratio sponge 江苏瑰奇新材料科技有限公司 2023-11-21 CN claimed
CN-116891459-A Synthesis method of polysubstituted triazinane compound 湖北九康通生物医药有限公司 2023-10-17 CN claimed
WO-2023193818-A1 METHOD FOR SYNTHESIZING POLYSUBSTITUTED TRIAZINE COMPOUND 湖北九康通生物医药有限公司 2023-10-12 WO claimed
CN-114878736-A Method for determining impurities in bifenazate 江苏恒生检测有限公司 2022-08-09 CN claimed
CN-114075129-A Sacubitril intermediate and synthetic method and application thereof 凯特立斯(深圳)科技有限公司 2022-02-22 CN claimed
CN-108084078-B Synthesis method of medicine apremilast for treating psoriatic arthritis diseases 中山大学 2021-07-30 CN claimed
CN-113150494-A PCB micro-foaming hole plugging resin and preparation method and application thereof 深圳市百柔新材料技术有限公司 2021-07-23 CN claimed
CN-109962438-B Flame-retardant and fireproof silicone rubber bridge and preparation method thereof 东莞市朗晟材料科技有限公司 2021-07-09 CN claimed
CN-109354818-B Tooth injection molding material, micro-foamed light zipper teeth, preparation method of micro-foamed light zipper teeth and micro-foamed tooth zipper 浙江伟星实业发展股份有限公司 2021-05-07 CN claimed
CN-108774192-B Method for synthesizing (E) -2-benzylidene-1, 2,3, 5-tetrahydrobenzo [ E ] [1,4] oxazepine 山东三牧新材料科技有限公司 2020-07-17 CN claimed
CN-108774191-B Method for synthesizing (E) -2-benzylidene-1, 2,3, 5-tetrahydrobenzo [ E ] [1,4] oxazepine 上海三牧化工技术有限公司 2020-07-14 CN claimed
CN-108997251-B Method for synthesizing (E) -2-benzylidene-1, 2,3, 5-tetrahydrobenzo [ E ] [1,4] oxazepine 上海三牧化工技术有限公司 2020-07-14 CN claimed
CN-106823278-B Comprehensive abdominal muscle training device 河南科技大学 2020-04-28 CN claimed
CN-110882634-A Formula of ethylene-chlorotrifluoroethylene copolymer microporous membrane and method for preparing microporous membrane by using formula 浙江省化工研究院有限公司 2020-03-17 CN claimed
US-5539102-A ANTIBIOTIC SYNTHESIS BY DEHYDRATION REACTION OF ALCOHOL WITH OXYCARBONYLSULFAMIDE IN THE PRESENCE OF TRIVALENT PHOSPHOROUS SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) 1996-07-23 US claimed
EP-3753936-B1 PYRIDONE DERIVATIVE, COMPOSITION THEREOF AND APPLICATION THEREOF AS ANTI-INFLUENZA DRUG JIANGXI CAISHI PHARMACEUTICAL TECH CO LTD (CN) 2026-04-08 EP disclosed
US-5055545-A Paint primers; bonding strength; tire sidewalls; decoration BRIDGESTONE/FIRESTONE, INC. (US) 1991-10-08 US disclosed
WO-1991000178-A1 BLOCK COPOLYMER ADHESIVES IN HOT MELTS AND POLYESTER LAMINATES EXXON CHEMICAL PATENTS INC. (US) 1991-01-10 WO disclosed