SCHEMBL29352197

SCHEMBL29352197

N#Cc1ccccc1C#N

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.63
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
ESR2 Q92731 1/20 0.48
MAOA P21397 3/20 0.46
MAOB P27338 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
MCL1 Q07820 1/20 0.46
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
IMPDH2 P12268 3/20 0.44
IMPDH1 P20839 2/20 0.44
GAA P10253 2/20 0.43
POLB P06746 1/20 0.43

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 SCHEMBL27896186 1.00 TSHR (0.63) TSHRCA1CA2ESR2MAOA
Water SCHEMBL19410621 1.00 TSHR (0.63) TSHRCA1CA2ESR2MAOA
SCHEMBL57480 1.00 TSHR (0.63) TSHRCA1CA2ESR2MAOA
SCHEMBL2818597 1.00 TSHR (0.63) TSHRCA1CA2ESR2MAOA
Charcoal, Activated SCHEMBL1376916 0.96 TSHR (0.60) TSHRCA1CA2ESR2MAOA
SCHEMBL6372765 0.96 TSHR (0.60) TSHRCA1CA2ESR2MAOA
Hydrogen Sulfide SCHEMBL1324202 0.96 TSHR (0.60) TSHRCA1CA2ESR2MAOA
Hydrochloric Acid SCHEMBL8884007 0.96 TSHR (0.60) TSHRCA1CA2ESR2MAOA
SCHEMBL3959857 0.96 TSHR (0.60) TSHRCA1CA2ESR2MAOA
Methane SCHEMBL18035842 0.96 TSHR (0.60) TSHRCA1CA2ESR2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3887428-B1 RESIN BLENDS INCLUDING PHTHALONITRILE RESIN AND THIADIAZOLE SUBSTITUTED PHTHALONITRILE COMPOUND, ARTICLES, COMPOUNDS, AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2026-05-27 EP claimed
EP-4055088-B1 COMPOSITION AND METHOD FOR MANUFACTURING RESINS CAMBIUM BIOMATERIALS INC (US) 2026-03-25 EP claimed
EP-3816137-B1 METHOD OF MANUFACTURING CMC COMPONENTS USING BORON CARBIDE GOODRICH CORP (US) 2026-03-18 EP claimed
EP-4049841-B1 HYBRID RESIN COMPOSITION CUBICURE GMBH (AT) 2026-03-18 EP claimed
EP-4148039-B1 METHOD FOR PREPARING PHTHALONITRILE-BASED COMPOUND KOREA KUMHO PETROCHEMICAL CO LTD (KR) 2026-03-11 EP claimed
EP-3782806-B1 HIGH TEMPERATURE HYBRID COMPOSITE LAMINATES RTX CORP (US) 2026-03-04 EP claimed
EP-3844424-B1 A GASKET FLEXITALLIC INVEST INC (US) 2026-01-07 EP claimed
CN-119905638-A Electrochemical device and electronic device 宁德新能源科技有限公司 2025-04-29 CN claimed
CN-119905639-A Electrochemical device and electronic device 宁德新能源科技有限公司 2025-04-29 CN claimed
CN-119390610-B Gas-solid phase catalytic reaction rectification separation integrated method 鞍山七彩化学股份有限公司 2025-03-28 CN claimed
WO-2022123179-A1 THERMOSET MATERIALS OBTAINED FROM SPECIFIC PHTHALONITRILE RESINS FOR HIGH-TEMPERATURE APPLICATIONS COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2022-06-16 WO claimed
EP-4010937-A1 ELECTROCHEMICAL APPARATUS AND ELECTRONIC APPARATUS Ningde Amperex Technology Limited (CN) 2022-06-15 EP claimed
CN-114628605-A Quantum dot light-emitting diode and preparation method thereof 合肥福纳科技有限公司 2022-06-14 CN claimed
CN-112778184-B Method for arylating alpha position of tertiary amine 绍兴文理学院 2022-05-17 CN claimed
EP-3536734-B1 POLYMERIZABLE COMPOSITION LG CHEMICAL LTD (KR) 2022-05-11 EP claimed
WO-2022077926-A1 ELECTROCHEMICAL APPARATUS AND ELECTRONIC APPARATUS NINGDE AMPEREX TECHNOLOGY LIMITED (CN) 2022-04-21 WO claimed
CN-112271327-B Electrolyte solution, and electrochemical device and electronic device containing the same 宁德新能源科技有限公司 2022-04-15 CN claimed
EP-3977547-A1 ELECTROCHEMICAL DEVICE Ningde Amperex Technology Ltd. (CN) 2022-04-06 EP claimed
EP-3546496-B1 COMPOUND LG CHEMICAL LTD (KR) 2022-02-23 EP claimed
CN-114006048-A Battery with a battery cell 珠海冠宇电池股份有限公司 2022-02-01 CN claimed