SCHEMBL2216606

SCHEMBL2216606

COC(=O)C(C)=CN

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL2333769 1.00
SCHEMBL28811422 0.82 BRD4 (0.36)
SCHEMBL19687170 0.80 ALDH1A1 (0.37)
SCHEMBL12957658 0.78
SCHEMBL15641383 0.78
SCHEMBL2971024 0.77
Ethylenediamine SCHEMBL17453352 0.77 ALDH1A1 (0.39)
Ethylamine SCHEMBL28816778 0.77 ALDH1A1 (0.39)
SCHEMBL25246818 0.77 ALDH1A1 (0.48)
SCHEMBL1821223 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112898892-A Water-based weather-resistant and scrubbing-resistant automobile coating and preparation method thereof 常州乐丽得新材料有限公司 2021-06-04 CN claimed
EP-0326389-B1 Process for preparing 4-hydroxypyrimidine UBE INDUSTRIES (JP) 1996-09-11 EP claimed
CN-1053811-A The rinse aid that is used for plastic and painted surface HENKEL CORP (US) 1991-08-14 CN claimed
US-4935516-A Process for preparing 4-hydroxypyrimidine UBE INDUSTRIES, LTD. (JP) 1990-06-19 US claimed
EP-0326389-A2 Process for preparing 4-hydroxypyrimidine UBE INDUSTRIES, LTD. (JP) 1989-08-02 EP claimed
EP-4213980-A1 AMINE MODIFIED POLYSACCHARIDE URETHANE/UREA MICROCAPSULES Encapsys, LLC (US) 2023-07-26 EP disclosed
CN-116209716-A Processing aid for vinyl chloride resin composition 株式会社钟化 2023-06-02 CN disclosed
CN-116063325-A Macrocyclic compounds with BTK modulating effect and uses thereof 赛诺哈勃药业(成都)有限公司 2023-05-05 CN disclosed
CN-115109756-A Method for reprogramming fibroblast into ovary-like granular cell and application thereof 清华大学 2022-09-27 CN disclosed
EP-2392599-B1 HIGHLY SATURATED COPOLYMER RUBBER CONTAINING NITRILE GROUPS ZEON CORP (JP) 2022-05-04 EP disclosed
WO-2022061103-A1 AMINE MODIFIED POLYSACCHARIDE URETHANE/UREA MICROCAPSULES ENCAPSYS, LLC (US) 2022-03-24 WO disclosed
CN-110373938-B Water-resistant paper-plastic composite material and preparation method thereof 天津科技大学 2021-12-10 CN disclosed
CN-1053811-A The rinse aid that is used for plastic and painted surface HENKEL CORP (US) 1991-08-14 CN disclosed
CN-1051725-A Glutaric acid derivatives and process for preparing the same PFIZER (US) 1991-05-29 CN disclosed
WO-1990012840-A2 COLOR BINDING MECHANISM FOR CONTACT LENSES SCHERING CORPORATION (US) 1990-11-01 WO disclosed
EP-0393532-A2 Color binding mechanism for contact lenses Wesley Jessen Corporation (US) 1990-10-24 EP disclosed
US-4935516-A Process for preparing 4-hydroxypyrimidine UBE INDUSTRIES, LTD. (JP) 1990-06-19 US disclosed
EP-0326389-A2 Process for preparing 4-hydroxypyrimidine UBE INDUSTRIES, LTD. (JP) 1989-08-02 EP disclosed
US-4596747-A Plastic film substrate, primer coating comprising carbon black dispersed in radiation curable unsaturated acryloyl containing material, magnetic layer TDK CORPORATION (JP) 1986-06-24 US disclosed
US-4179382-A SOFTENERS THE PROCTER & GAMBLE COMPANY (US) 1979-12-18 US disclosed