SCHEMBL28512357

SCHEMBL28512357

O=C(O)CC(OP(=O)(O)C(CC(=O)O)c1ccccc1)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 3/20 0.42
GABBR2 O75899 1/20 0.40
GABBR1 Q9UBS5 1/20 0.40
SRC P12931 1/20 0.38
POLB P06746 1/20 0.37
CYP2C19 P33261 1/20 0.37
FFAR1 O14842 3/20 0.37

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
SCHEMBL8790003 0.83 GABBR2 (0.44) ACP3GABBR2GABBR1SRCPOLB
SCHEMBL11297322 0.78 ACP3 (0.61) ACP3GABBR2GABBR1SRCCYP2C19
SCHEMBL10894321 0.73 GABBR2 (0.49) ACP3GABBR2GABBR1SRCCYP2C19
SCHEMBL28867950 0.73 ACP3 (0.41) ACP3SRCPOLB
SCHEMBL2173719 0.72 ACP3 (0.46) ACP3GABBR2GABBR1SRCCYP2C19
SCHEMBL2171520 0.72 ACP3 (0.46) ACP3GABBR2GABBR1SRCPOLB
SCHEMBL16573649 0.72 GABBR2 (0.50) GABBR2GABBR1SRCCYP2C19FFAR1
SCHEMBL15641732 0.71 CYP1A2 (0.45) ACP3GABBR2GABBR1SRCCYP2C19
SCHEMBL3290815 0.71 GABBR2 (0.48) GABBR2GABBR1CYP2C19FFAR1
SCHEMBL7626463 0.71 GABBR2 (0.53) GABBR2GABBR1CYP2C19FFAR1

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-109137124-B Preparation method of flame-retardant fabric 昱天(上海)新材料有限公司 2020-12-22 CN claimed
CN-109761530-A A kind of epoxy resin concrete material with cracking resistance 深圳市欧科力科技有限公司 2019-05-17 CN claimed
CN-109137124-A A kind of preparation method of inflaming retarding fabric 盛世瑶兰(深圳)科技有限公司 2019-01-04 CN claimed
CN-109137124-B Preparation method of flame-retardant fabric 昱天(上海)新材料有限公司 2020-12-22 CN disclosed
CN-109137124-B Preparation method of flame-retardant fabric 昱天(上海)新材料有限公司 2020-12-22 CN disclosed
CN-109761530-A A kind of epoxy resin concrete material with cracking resistance 深圳市欧科力科技有限公司 2019-05-17 CN disclosed
CN-109761530-A A kind of epoxy resin concrete material with cracking resistance 深圳市欧科力科技有限公司 2019-05-17 CN disclosed
CN-109137124-A A kind of preparation method of inflaming retarding fabric 盛世瑶兰(深圳)科技有限公司 2019-01-04 CN disclosed
CN-109137124-A A kind of preparation method of inflaming retarding fabric 盛世瑶兰(深圳)科技有限公司 2019-01-04 CN disclosed