SCHEMBL1000340

SCHEMBL1000340

CC(C)=C(C)CBr

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
SCHEMBL1965616 0.82
SCHEMBL2023828 0.82
SCHEMBL14852728 0.72
SCHEMBL24383798 0.72
SCHEMBL8336163 0.72
SCHEMBL473764 0.67
SCHEMBL11592495 0.64
SCHEMBL2864265 0.64
SCHEMBL67200 0.64
SCHEMBL9051136 0.64 ALDH1A1 (0.33)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3716956-B1 ANTITUMOR TET2 MODULATING COMPOUNDS CLEVELAND CLINIC FOUND (US) 2024-06-26 EP disclosed
CN-117945844-A Third monomer for EVA synthesis, modified EVA and application of modified EVA in EVOH synthesis 中国科学院长春应用化学研究所 2024-04-30 CN disclosed
US-11760770-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2023-09-19 US disclosed
US-20210317143-A9 BORONIC ESTER PRODRUGS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2021-10-14 US disclosed
WO-2020236253-A1 BORONIC ESTER PRODRUGS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2020-11-26 WO disclosed
US-20200369685-A1 BORONIC ESTER PRODRUGS AND USES THEREOF MASSACHUSETTS INST TECHNOLOGY (US) 2020-11-26 US disclosed
EP-2863914-B1 PYRAZOLYL DERIVATIVES AS SYK INHIBITORS MERCK SHARP & DOHME (US) 2018-10-03 EP disclosed
US-9243004-B2 Synthesis of boronic esters and boronic acids using grignard reagents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-01-26 US disclosed
US-9242984-B2 Pyrazolyl derivatives as Syk inhibitors MERCK SHARP & DOHME CORP. (US) 2016-01-26 US disclosed
US-20150191461-A1 PYRAZOLYL DERIVATIVES AS SYK INHIBITORS MERCK SHARP & DOHME CORP. (US) 2015-07-09 US disclosed
US-5202386-A Adhesion to polar material AKZO NV (NL) 1993-04-13 US disclosed
US-5037892-A Epoxidation Of Olefin Polymers AKZO N.V. (NL) 1991-08-06 US disclosed
EP-0322945-A1 Modification of (co)polymers employing organic peroxides Akzo Nobel N.V. (NL) 1989-07-05 EP disclosed
EP-0108627-A2 Cephalosporin derivatives and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-05-16 EP disclosed
US-4226892-A Flavoring with cycloaliphatic unsaturated ketones FIRMENICH SA (CH) 1980-10-07 US disclosed
US-4187863-A Cycloaliphatic unsaturated ketones as odor and taste modifying agents in tobacco products FIRMENICH SA (CH) 1980-02-12 US disclosed
US-4048178-A Novel N-allyl and N-propargyl benzmorphan derivatives SMITH KLINE & FRENCH LABORATORIES (US) 1977-09-13 US disclosed
US-3975310-A PERFUME FIRMENICH S.A. (CH) 1976-08-17 US disclosed
US-3936462-A CNS DEPRESSANT, ANALGESIC STERLING DRUG INC. (US) 1976-02-03 US disclosed
US-3931326-A FLAVOR, TASTE, ODOR, PERFUMES FIRMENICH SA (CH) 1976-01-06 US disclosed