SCHEMBL87647

SCHEMBL87647

C=CCNC(=O)OCC

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
Methyl Alcohol SCHEMBL11130161 0.98 ALDH1A1 (0.46) —
Acrylic Acid SCHEMBL30356563 0.92 ALDH1A1 (0.43) —
Acrylic Acid SCHEMBL30356562 0.92 ALDH1A1 (0.43) —
Acrylic Acid SCHEMBL30356560 0.92 ALDH1A1 (0.43) —
Acrylic Acid SCHEMBL2476698 0.92 ALDH1A1 (0.43) —
SCHEMBL27746026 0.92 ALDH1A1 (0.43) —
Methacrylic Acid SCHEMBL2475283 0.89 ALDH1A1 (0.41) —
SCHEMBL25271952 0.87 ALDH1A1 (0.42) —
SCHEMBL13525264 0.84 ALDH1A1 (0.40) —
SCHEMBL13863367 0.84 NPSR1 (0.43) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4399242-A1 SULFUR-CROSSLINKABLE RUBBER-COATING MIXTURE, AND PNEUMATIC VEHICLE TYRE Continental Reifen Deutschland GmbH (DE) 2024-07-17 — — EP claimed
CN-117940506-A Sulfur-crosslinkable rubber coating mixture and pneumatic vehicle tire 大陆轮胎德国有限公司 2024-04-26 — — CN claimed
US-11845838-B2 Compositions and methods for crosslinking polymers in the presence of atmospheric oxygen ARKEMA INC. (US) 2023-12-19 — — US claimed
US-11840803-B2 Non-fluorinated fiber and textile treatment compositions and applications thereof Wilana Chemical LLC (US) 2023-12-12 — — US claimed
WO-2023190759-A1 WATER-REPELLENT POLYACRYLONITRILE-BASED SYNTHETIC HAIR FIBER, METHOD FOR PRODUCING SAME, AND HEADDRESS PRODUCT 株式会社カネカ 2023-10-05 — — WO claimed
CN-116635493-A Copolymers having viscoelastic and suspension properties 可泰克斯公司 2023-08-22 — — CN claimed
CN-115721634-B Atomoxetine hydrochloride composition, preparation method thereof and application thereof in oral solution 海南卓科制药有限公司 2023-07-14 — — CN claimed
US-20230151190-A1 SULFUR-CROSSLINKABLE RUBBER-COATING MIXTURE CONTINENTAL REIFEN DEUTSCHLAND GMBH (DE) 2023-05-18 — — US claimed
US-20230151214-A1 SULFUR-CROSSLINKABLE RUBBER-COATING MIXTURE CONTINENTAL REIFEN DEUTSCHLAND GMBH (DE) 2023-05-18 — — US claimed
CN-115721634-A Tomoxetine hydrochloride composition, preparation method thereof and application thereof in oral solution 海南卓科制药有限公司 2023-03-03 — — CN claimed
US-5126476-A Reaction of aromatic compound with alkylenebis(alkyl carbamate) in presence of acid catalyst and polar aprotic solv ent ARCO CHEMICAL TECHNOLOGY, L.P. (US) 1992-06-30 — — US claimed
EP-0485531-A1 CROSSLINKED POLYMER ELECTROLYTE AND METHODS OF MAKING THE SAME SPECIALISED CONDUCTIVES PTY. LIMITED (AU) 1992-05-20 — — EP claimed
EP-0189987-B1 POLYMERISABLE URETHANE COMPOSITIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-04-29 — — EP claimed
US-5089586-A Reaction of a polyglycol mixture with a hydroxyallyl compound and an isocyanate WOLFF WALSRODE AKTIENGESELLSCHAFT (DE) 1992-02-18 — — US claimed
US-5078754-A Abrasive Implement For Shaping Of A Dental Composite Restorative Material DENTSPLY RESEARCH & DEVELOPMENT CORP. (US) 1992-01-07 — — US claimed
WO-1991006585-A1 CROSSLINKED POLYMER ELECTROLYTE AND METHODS OF MAKING THE SAME SPECIALISED CONDUCTIVES PTY. LIMITED (AU) 1991-05-16 — — WO claimed
EP-0356847-A2 Allylurethanes and use thereof for the production of lacquers Wolff Walsrode Aktiengesellschaft (DE) 1990-03-07 — — EP claimed
EP-0353638-A2 Finishing/polishing system DENTSPLY INTERNATIONAL, INC. (US) 1990-02-07 — — EP claimed
US-4755564-A Graft polymers BAYER AKTIENGESELLSCHAFT (DE) 1988-07-05 — — US claimed
US-4710561-A [Poly]imidazoline adduct for electrocoating KANSAI PAINT CO., LTD. (JP) 1987-12-01 — — US claimed
Send feedback