SCHEMBL33780

SCHEMBL33780

C=C(C)C(=O)OCCC#N

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.52
TSHR P16473 4/20 0.50
ALDH1A1 P00352 3/20 0.40
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
TDP2 O95551 1/20 0.30
CYP1A2 P05177 1/20 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
Acetic Acid SCHEMBL28158415 0.96 THRB (0.48) THRBTSHRALDH1A1POLBAPEX1
Cyanamide SCHEMBL28026068 0.94 THRB (0.47) THRBTSHRALDH1A1POLBAPEX1
Methacrylic Acid SCHEMBL9453881 0.94 THRB (0.47) THRBTSHRALDH1A1POLBAPEX1
Methacrylic Acid SCHEMBL10424224 0.94 THRB (0.47) THRBTSHRALDH1A1POLBAPEX1
Carbamic Acid SCHEMBL28329175 0.93 THRB (0.46) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL28134507 0.93 THRB (0.46) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL10433862 0.93 THRB (0.55) THRBTSHRALDH1A1POLBAPEX1
Phosphonic Acid SCHEMBL28048733 0.93 THRB (0.46) THRBTSHRALDH1A1POLBAPEX1
Propionic Acid SCHEMBL28009092 0.91 THRB (0.49) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL28039568 0.91 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1

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 6212 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4316470-B1 NEW FORMULATIONS BETAGENON AB (SE) 2026-04-29 EP claimed
US-20260028489-A1 SUPPORTED POLYMERIZATION INHIBITORS AND THEIR USE IN CURABLE COMPOSITIONS FOR 3D PRINTING ALIGN TECHNOLOGY INC (US) 2026-01-29 US claimed
US-20250197658-A1 ANTIOXIDANT STABILIZERS FOR DIRECT FABRICATION OF ORTHODONTIC APPLIANCES ALIGN TECHNOLOGY, INC. 2025-06-19 US claimed
US-20250179236-A1 POLYETHER-CONTAINING POLYMERIZABLE COMPOUNDS AND USE IN CURABLE RESIN COMPOSITIONS ALIGN TECHNOLOGY, INC. 2025-06-05 US claimed
US-20250179305-A1 LASER MARKABLE RESIN COMPOSITIONS FOR ORTHODONTIC APPLIANCES ALIGN TECHNOLOGY, INC. 2025-06-05 US claimed
CN-120048294-A Photopolymer holographic recording medium, preparation method and application thereof 珠海莫界科技有限公司 2025-05-27 CN claimed
EP-4539825-A1 BILAYER TABLETS OF VALSARTAN AND INDAPAMIDE KRKA, D.D., Novo Mesto (SI) 2025-04-23 EP claimed
CN-118806764-A Sustained release formulations and methods of use thereof 珐博进(中国)医药技术开发有限公司 2024-10-22 CN claimed
EP-4316470-A2 NEW FORMULATIONS Betagenon AB (SE) 2024-02-07 EP claimed
CN-117510738-A Impact modifier for resin and preparation method thereof 山东金昌树新材料股份有限公司 2024-02-06 CN claimed
EP-0312228-A1 Polymeric additives for use in adhesive compositions ROHM AND HAAS COMPANY (US) 1989-04-19 EP claimed
US-4818801-A IMPROVED OXYGEN PERMEABILITY; CONTACT LENSES MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-04-04 US claimed
EP-0183989-A2 Fluorine-containing graft copolymer and adhesive and composite membrane made thereof SAGAMI CHEMICAL RESEARCH CENTER (JP) 1986-06-11 EP claimed
US-4543398-A Ophthalmic devices fabricated from urethane acrylates of polysiloxane alcohols MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1985-09-24 US claimed
EP-0127321-A1 Ophthalmic devices fabricated from urethane acrylates of polysiloxane alcohols MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-12-05 EP claimed
US-4440918-A OXYGEN PERMEABILITY MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-04-03 US claimed
US-4344906-A VINYLAROMATIC, MALEIC ANHYDRIDE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-08-17 US claimed
US-4297431-A POLYMERS OF ACRYLIC ESTERS AS OVERCOATS OR TIMING LAYERS FOR LIGHT SENSITIVE ELEMENTS POLAROID CORPORATION (US) 1981-10-27 US claimed
US-4201587-A Graft copolymers as diffusion control layers in photographic diffusion transfer products POLAROID CORPORATION (US) 1980-05-06 US claimed
US-4120727-A GRAIN-GROWING PROTECTIVE COLLOID POLAROID CORPORATION (US) 1978-10-17 US claimed