SCHEMBL6283558

SCHEMBL6283558

C=C(CCC)C(=O)OOCC

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
HDAC3 O15379 4/20 0.33
HDAC1 Q13547 4/20 0.33
HDAC2 Q92769 4/20 0.33
HDAC8 Q9BY41 4/20 0.33
FFAR3 O14843 3/20 0.33
TSHR P16473 4/20 0.32
THRB P10828 1/20 0.31
HDAC6 Q9UBN7 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
SCHEMBL7075017 0.88 CES1 (0.39) ALDH1A1CES2CES1TSHR
SCHEMBL12814270 0.85 ALDH1A1 (0.34) ALDH1A1CES2CES1HDAC3HDAC1
SCHEMBL27993005 0.83 THRB (0.46) ALDH1A1TSHRTHRB
SCHEMBL999635 0.82 ALDH1A1 (0.34) ALDH1A1TSHRTHRB
SCHEMBL10878315 0.82 ALDH1A1 (0.39) ALDH1A1CES2CES1HDAC3HDAC1
SCHEMBL27746217 0.82 ALDH1A1 (0.32) ALDH1A1CES2CES1HDAC3HDAC1
SCHEMBL8026694 0.80 THRB (0.39) ALDH1A1CES2CES1TSHRTHRB
SCHEMBL3012940 0.80 ALDH1A1 (0.37) ALDH1A1CES2CES1HDAC3HDAC1
Hydrochloric Acid SCHEMBL27667583 0.80 ALDH1A1 (0.33) ALDH1A1TSHRTHRB
SCHEMBL61201 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021238577-A1 POLYMER FILM FOR BIOSENSOR AND PREPARATION METHOD THEREFOR 深圳硅基传感科技有限公司 2021-12-02 WO claimed
US-4851318-A Process for encapsulated toner compositions with oligomeric surfactant emulsifiers XEROX CORPORATION (US) 1989-07-25 US claimed
CN-114656589-B Underwater direct operation type high-strength wet adhesive material and preparation method and application thereof 中国科学院兰州化学物理研究所 2022-11-11 CN disclosed
CN-114656589-A Underwater direct operation type high-strength wet adhesive material and preparation method and application thereof 中国科学院兰州化学物理研究所 2022-06-24 CN disclosed
CN-109943264-B High-strength wet-adhesion bionic adhesive material and method and application thereof 中国科学院兰州化学物理研究所 2020-02-07 CN disclosed
CN-109602694-A Medicinal gel and its preparation method and application before camptothecine 四川大学华西医院 2019-04-12 CN disclosed
US-20150343192-A1 LIQUID MEDICINE INJECTION DEVICE OF SUBCUTANEOUS IMPLANT TYPE TERUMO CLINICAL SUPPLY CO., LTD. (JP) 2015-12-03 US disclosed
US-9062188-B2 Acrylic rubber composition NOK CORPORATION (JP) 2015-06-23 US disclosed
EP-2568011-B1 ACRYLIC RUBBER COMPOSITION NOK CORP (JP) 2014-11-26 EP disclosed
EP-2796163-A1 SUBCUTANEOUSLY IMPLANTED DEVICE FOR INJECTING DRUG SOLUTION Terumo Clinical Supply Co., Ltd. (JP) 2014-10-29 EP disclosed
US-20140005339-A1 ACRYLIC RUBBER COMPOSITION NOK CORPORATION (JP) 2014-01-02 US disclosed
US-4409343-A DIENE AND VINYLPHYRIDINE COPOLYMERS THE GENERAL TIRE & RUBBER COMPANY (US) 1983-10-11 US disclosed
US-4355131-A Adhesion of rubber to glass fibers THE GENERAL TIRE & RUBBER COMPANY (US) 1982-10-19 US disclosed
EP-0017703-A1 Copolymerizable (2-cyano-3,3-diarylacryloxy)alkylene compounds, a method of making them and the use of these compounds as ultraviolet light absorbers GAF CORPORATION (US) 1980-10-29 EP disclosed
US-4218392-A Two-step method of making copolymerizable, ultraviolet light absorber _2-cyano-3,3-diphenylacryloxy) alkylene acrylic acid esters GAF CORPORATION (US) 1980-08-19 US disclosed
US-4207253-A Method of making copolymerizable, ultraviolet light absorber (2-cyano-3,3-diphenylacryloxy) alkylene acrylic acid esters GAF CORPORATION (US) 1980-06-10 US disclosed
US-4178303-A (2-Cyano-3,3-diphenylacryloxy) alkylene acrylic acid esters GAF CORPORATION (US) 1979-12-11 US disclosed
US-4131563-A Process of preparing substantially solid waste containing radioactive or toxic substances for safe, non-pollutive handling, transportation and permanent storage STEAG KERNENERGIE G.M.B.H. (DE) 1978-12-26 US disclosed
US-4009116-A Process of preparing substantially organic waste liquids containing radioactive or toxic substances for safe, non-pollutive handling, transportation and permanent storage BAYER AKTIENGESELLSCHAFT (DT) 1977-02-22 US disclosed
US-3975205-A ION EXCHANGING SUDDEUTSCHE ZUCKER-AKTIENGESELLSCHAFT (DT) 1976-08-17 US disclosed