SCHEMBL9300862

SCHEMBL9300862

CCCC(=O)Cc1ccc(Br)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
POLB P06746 1/20 0.46
CTDSP1 Q9GZU7 1/20 0.46
MEN1 O00255 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
KDM4E B2RXH2 1/20 0.44
GLA P06280 1/20 0.44
IAPP P10997 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
EGFR P00533 1/20 0.42
ERBB2 P04626 1/20 0.42
CNR2 P34972 1/20 0.42
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL28493644 0.89 KMT2A (0.47) KMT2APOLBCTDSP1MEN1KDM4E
SCHEMBL4541922 0.83 ALDH1A1 (0.48) KMT2APOLBMEN1L3MBTL1IAPP
SCHEMBL3868190 0.83 KMT2A (0.49) KMT2APOLBCTDSP1MEN1L3MBTL1
SCHEMBL1449785 0.83 MEN1 (0.52) KMT2AMEN1L3MBTL1KDM4EGLA
SCHEMBL9709577 0.82 IAPP (0.59) POLBCTDSP1IAPP
SCHEMBL106914 0.82 CA2 (0.54) L3MBTL1KDM4EIAPPTDP1EGFR
SCHEMBL5548416 0.82 IAPP (0.44) POLBL3MBTL1KDM4EIAPPTDP1
SCHEMBL1411319 0.82 L3MBTL1 (0.62) KMT2AMEN1L3MBTL1IAPPTDP1
SCHEMBL6103810 0.82 MEN1 (0.44) KMT2AMEN1L3MBTL1KDM4EGLA
SCHEMBL7256785 0.80 ALDH1A1 (0.49) KMT2APOLBCTDSP1MEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113825748-A Antimicrobial compounds and methods 库扎环球有限责任公司 2021-12-21 CN disclosed
EP-3911643-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
CN-110208414-B Analysis method for quantitatively determining more than target flavor components in tobacco 中国烟草总公司郑州烟草研究院 2021-10-15 CN disclosed
CN-110133156-B Analysis method for high-throughput determination of multi-target aroma components in electronic cigarette liquid 中国烟草总公司郑州烟草研究院 2021-10-15 CN disclosed
CN-110133155-B Gas chromatography-tandem mass spectrometry analysis method of tobacco essence and flavor 中国烟草总公司郑州烟草研究院 2021-09-14 CN disclosed
WO-2020150372-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed
WO-2017107052-A1 SOLUBLE GUANYLATE CYCLASE STIMULATORS MERCK SHARP & DOHME CORP. (US) 2017-06-29 WO disclosed
US-5356893-A Antidepressants, nervous system disorders GLAXO GROUP LIMITED (GB) 1994-10-18 US disclosed
EP-0533266-A1 Benzanilide derivatives as 5-HT1D antagonists GLAXO GROUP LIMITED (GB) 1993-03-24 EP disclosed