SCHEMBL789070

SCHEMBL789070

CC(Br)C(=O)C(=O)O

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
SCHEMBL11161122 0.82 ALDH1A1 (0.38)
SCHEMBL31378963 0.76 ALDH1A1 (0.33)
SCHEMBL4141435 0.75 CYP2C19 (0.40)
SCHEMBL1243000 0.75 ALDH1A1 (0.35)
SCHEMBL51944 0.74
SCHEMBL233694 0.74
SCHEMBL233072 0.74
SCHEMBL10309428 0.73
Methane SCHEMBL1576574 0.72
SCHEMBL10408806 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220089542-A1 PROCESS FOR PREPARATION OF ALDEHYDE SCAVENGER AND INTERMEDIATES ALDEYRA THERAPEUTICS, INC. 2022-03-24 US claimed
WO-2020223717-A1 PROCESS FOR PREPARATION OF ALDEHYDE SCAVENGER AND INTERMEDIATES ALDEYRA THERAPEUTICS, INC. (US) 2020-11-05 WO claimed
EP-0502195-A1 PROCESS FOR PRODUCING L-$g(b)-HALOALANINE NIPPON STEEL CORPORATION (JP) 1992-09-09 EP claimed
EP-0021923-B1 PROCESS FOR THE PREPARATION OF VINCAMINE DERIVATIVES SYNTHELABO (FR) 1983-09-07 EP claimed
US-20260022125-A1 PYRROLOPYRIDAZINE VEGFR INHIBITORS MERCK SHARP & DOHME LLC (US) 2026-01-22 US disclosed
US-20250290137-A1 SUBSTITUTED COUMARIN DYES AND USES AS FLUORESCENT LABELS ILLUMINA CAMBRIDGE LIMITED (GB) 2025-09-18 US disclosed
US-12351871-B2 Substituted coumarin dyes and uses as fluorescent labels ILLUMINA CAMBRIDGE LIMITED (GB) 2025-07-08 US disclosed
US-20240271209-A1 SUBSTITUTED COUMARIN DYES AND USES AS FLUORESCENT LABELS ILLUMINA CAMBRIDGE LIMITED (GB) 2024-08-15 US disclosed
US-11981964-B2 Substituted coumarin dyes and uses as fluorescent labels ILLUMINA CAMBRIDGE LIMITED (GB) 2024-05-14 US disclosed
EP-4188921-A1 SUBSTITUTED COUMARIN DYES AND USES AS FLUORESCENT LABELS Illumina Cambridge Limited (GB) 2023-06-07 EP disclosed
CN-115867544-A Substituted coumarin dyes and their use as fluorescent labels 伊鲁米纳剑桥有限公司 2023-03-28 CN disclosed
US-11465997-B2 Synthesis of disorazoles and analogs thereof as potent anticancer agents WILLIAM MARSH RICE UNIVERSITY (US) 2022-10-11 US disclosed
EP-0502195-A1 PROCESS FOR PRODUCING L-$g(b)-HALOALANINE NIPPON STEEL CORPORATION (JP) 1992-09-09 EP disclosed
EP-0502195-A1 PROCESS FOR PRODUCING L-$g(b)-HALOALANINE NIPPON STEEL CORPORATION (JP) 1992-09-09 EP disclosed
WO-1992005268-A1 PROCESS FOR PRODUCING L-β-HALOALANINE NIPPON STEEL CORPORATION (JP) 1992-04-02 WO disclosed
US-4457936-A ENZYME INHIBITORS HOECHST AKTIENGESELLSCHAFT (DE) 1984-07-03 US disclosed
US-4257947-A INTERMEDIATES FOR ANTIBACTERIAL CEPHALOSPORINS SMITHKLINE CORPORATION (US) 1981-03-24 US disclosed
US-4166816-A CYCLIZATION SMITHKLINE CORPORATION (US) 1979-09-04 US disclosed
US-4103086-A 8-Oxo-4-thia-1-azabicyclo (4.2.0)-oct-2-ene derivatives SMITHKLINE CORPORATION (US) 1978-07-25 US disclosed
US-4072674-A FOR CEPHALOSPORIN CONGENERS SMITHKLINE CORPORATION (US) 1978-02-07 US disclosed