SCHEMBL4511932

SCHEMBL4511932

O=C1CCC(=O)N1Br.[NaH]

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
SCHEMBL10376304 0.96
SCHEMBL4011609 0.96 BRD4 (0.30)
SCHEMBL58 0.96
SCHEMBL2201542 0.96
Bromide SCHEMBL4047360 0.93
Fluoride SCHEMBL7176780 0.93
Bromide SCHEMBL10565259 0.90
SCHEMBL6675001 0.87 PARL (0.30)
SCHEMBL6058527 0.87 KMT2A (0.30)
Benzene SCHEMBL11532219 0.87 PARL (0.39)

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112390813-B Non-fullerene electron acceptor material and organic photovoltaic cell 位速科技股份有限公司 2022-06-03 CN disclosed
CN-112390813-A Non-fullerene electron acceptor material and organic photovoltaic cell 位速科技股份有限公司 2021-02-23 CN disclosed
US-7521570-B2 Medicinal compositions containing 6-hydroxybenzbromarone or salts thereof TORLI PHARMACEUTICAL CO., LTD. (JP) 2009-04-21 US disclosed
US-20070185195-A1 Medicinal compositions containing 6-hydroxybenzbromarone or salts thereof HUMAN CELL SYSTEMS, INC. (JP) 2007-08-09 US disclosed
EP-1767531-A1 MEDICINAL COMPOSITIONS CONTAINING 6-HYDROXYBENZBROMARONE OR SALTS THEREOF Torii Pharmaceutical Co., Ltd. (JP) 2007-03-28 EP disclosed