SCHEMBL95691

SCHEMBL95691

CCOP(=O)(CC#N)OCC

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.59
ACHE P22303 1/20 0.45
PPARD Q03181 2/20 0.44
TP53 P04637 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL413328 0.98 TSHR (0.56) TSHRACHEPPARDTP53TDP1
SCHEMBL9248074 0.98 TSHR (0.56) TSHRACHEPPARDTP53TDP1
SCHEMBL7367885 0.95 TSHR (0.54) TSHRACHEPPARDTP53TDP1
SCHEMBL25093119 0.89 TSHR (0.48) TSHRACHEPPARDTP53TDP1
SCHEMBL19249492 0.89 TSHR (0.48) TSHRACHEPPARDTP53TDP1
SCHEMBL19399063 0.89 TSHR (0.52) TSHRACHEPPARDTP53TDP1
SCHEMBL21841220 0.83 TSHR (0.46) TSHRACHEPPARDTP53TDP1
SCHEMBL15319121 0.81 TSHR (0.37) TSHRACHEMEN1KMT2A
SCHEMBL20526207 0.79 TSHR (0.65) TSHRACHEPPARDTP53TDP1
SCHEMBL2553720 0.78

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

Appears in 3628 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122051391-A Nonaqueous electrolyte and lithium battery 张家港市国泰华荣化工新材料有限公司 2026-05-15 CN claimed
EP-4641695-A1 ELECTROCHEMICAL APPARATUS AND ELECTRONIC DEVICE Dongguan Amperex Technology Limited (CN) 2025-10-29 EP claimed
US-12351586-B2 Thiophene[2,3-d]pyrimidine derivative DK6-1 and its preparation method and application SHAN DONG UNIVERSITY (CN) 2025-07-08 US claimed
CN-120058664-A Melatonin receptor agonist, and preparation method and application thereof 宜昌市中心人民医院(三峡大学第一临床医学院、三峡大学附属中心人民医院) 2025-05-30 CN claimed
CN-119998963-A Electrochemical device and electronic apparatus 东莞新能源科技有限公司 2025-05-13 CN claimed
CN-119954861-A Organic compound, hole transport layer, perovskite solar cell and preparation method 天合光能股份有限公司 2025-05-09 CN claimed
CN-119601761-A Gel type lithium ion battery 华彩(合肥)新能源科技有限公司 2025-03-11 CN claimed
CN-119542536-A Lithium ion battery electrolyte additive and electrolyte 华鼎国联四川动力电池有限公司 2025-02-28 CN claimed
CN-119504565-A Preparation method of N-substituent-2, 2-dimethyl-3-cyano piperidine 浙江药领医药科技有限公司 2025-02-25 CN claimed
CN-119481277-A Lithium ion battery electrolyte and application thereof 远景睿泰动力技术(上海)有限公司 2025-02-18 CN claimed
US-7276637-B2 Synthesis of cyclohexanone derivatives MERCK SHARP & DOHME LIMITED (GB) 2007-10-02 US claimed
EP-1709048-A2 METHOD OF PREPARING PORPHYRIN DERIVATIVES, PORPHYRIN DERIVATIVES, USES THEREOF AND PHARMACEUTICAL COMPOSITIONS Photobiochem N.V. (NL) 2006-10-11 EP claimed
US-20050222456-A1 Synthesis of cyclohexanone derivatives MERCK SHARP & DOHME LTD. (GB) 2005-10-06 US claimed
EP-1099694-B1 PROCESS FOR THE PREPARATION OF QUINOLINE DERIVATIVE AND INTERMEDIATE THEREFOR NISSAN CHEMICAL IND LTD (JP) 2005-08-17 EP claimed
WO-2005058909-A2 METHOD OF PREPARING PORPHYRIN DERIVATIVES, PORPHYRIN DERIVATIVES, USES THEREOF AND PHARMACEUTICAL COMPOSITIONS PHOTOBIOCHEM N.V. (NL) 2005-06-30 WO claimed
WO-2004013090-A1 SYNTHESIS OF CYCLOHEXANONE DERIVATIVES MERCK SHARP & DOHME LIMITED (GB) 2004-02-12 WO claimed
US-6335449-B1 ANTICHOLESTEROL, ENZYME INHIBITOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2002-01-01 US claimed
EP-1099694-A1 PROCESS FOR THE PREPARATION OF QUINOLINE DERIVATIVE AND INTERMEDIATE THEREFOR Nissan Chemical Industries, Ltd. (JP) 2001-05-16 EP claimed
US-5665802-A REACTING POLYAMIC ACID WITH A DEHYDRATION-CYCLIZATION AGENT, A CATALYST AND AN ORGANIC PHOSPHORUS COMPOUND; EXCELLENT IN TENSILE STRENGTH AND FLEXIBILITY KANEGAFUCHI KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1997-09-09 US claimed
EP-0260305-B1 QUINOLINYL ETHER TETRAZOLE AS AGENT FOR THE TREATMENT OF HYPERSENSITIVE AILMENTS RHONE-POULENC RORER INTERNATIONAL (HOLDINGS) INC. (US) 1992-12-16 EP claimed