SCHEMBL27809496

SCHEMBL27809496

Cc1ccc(OCC2CO2)c(Br)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.54
GLA P06280 1/20 0.54
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C19 P33261 1/20 0.49
L3MBTL1 Q9Y468 5/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 6/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
HPGD P15428 4/20 0.47
MAPT P10636 4/20 0.47
KDM4E B2RXH2 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
TSHR P16473 3/20 0.45
TP53 P04637 1/20 0.45
CYP3A4 P08684 1/20 0.45
HIF1A Q16665 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL7953345 0.85 ALDH1A1 (0.64) ALDH1A1GLACYP1A2L3MBTL1MEN1
SCHEMBL7953349 0.85 ALDH1A1 (0.64) ALDH1A1GLACYP1A2L3MBTL1MEN1
SCHEMBL262508 0.85 ALDH1A1 (0.64) ALDH1A1GLACYP1A2L3MBTL1MEN1
SCHEMBL27131262 0.85 ALDH1A1 (0.59) ALDH1A1GLACYP1A2CYP2C19L3MBTL1
SCHEMBL4892470 0.83 ALDH1A1 (0.49) ALDH1A1GLACYP1A2L3MBTL1MEN1
SCHEMBL30524198 0.83 ALDH1A1 (0.49) ALDH1A1GLACYP1A2L3MBTL1MEN1
SCHEMBL31213024 0.81 ALDH1A1 (0.64) ALDH1A1GLACYP1A2MEN1KMT2A
SCHEMBL4945160 0.81 ALDH1A1 (0.64) ALDH1A1GLACYP1A2MEN1KMT2A
SCHEMBL467256 0.81 ALDH1A1 (0.60) ALDH1A1GLACYP1A2L3MBTL1MEN1
SCHEMBL31290868 0.81 ALDH1A1 (0.60) ALDH1A1GLACYP1A2L3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109535632-A A kind of resistance to ageing-resistant Antiskid pencil cover material of migration of ballpoint pen shell 许五妮 2019-03-29 CN claimed
CN-109354813-A The ageing-resistant protection cover material of a kind of electronic equipment shell 蚌埠心里程教育科技有限公司 2019-02-19 CN claimed
CN-102394313-B Composite polymer electrolyte CHEN ZHAOGUO 2014-03-12 CN claimed
CN-102394313-A Composite polymer electrolyte ZHAOGUO CHEN 2012-03-28 CN claimed
CN-101805494-A Natural fiber resin composite and preparation method thereof LONGHAI NET CHEMICAL CO LTD 2010-08-18 CN claimed
CN-109535632-A A kind of resistance to ageing-resistant Antiskid pencil cover material of migration of ballpoint pen shell 许五妮 2019-03-29 CN disclosed
CN-109354813-A The ageing-resistant protection cover material of a kind of electronic equipment shell 蚌埠心里程教育科技有限公司 2019-02-19 CN disclosed
CN-102394313-B Composite polymer electrolyte CHEN ZHAOGUO 2014-03-12 CN disclosed
CN-102394313-A Composite polymer electrolyte ZHAOGUO CHEN 2012-03-28 CN disclosed
CN-101805494-A Natural fiber resin composite and preparation method thereof LONGHAI NET CHEMICAL CO LTD 2010-08-18 CN disclosed