SCHEMBL4457864

SCHEMBL4457864

Cc1ccc(OP(=O)(O)OP(=O)(O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.57
CYP3A4 P08684 1/20 0.57
LMNA P02545 4/20 0.43
BTN3A1 O00481 1/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
SRC P12931 1/20 0.42
BLM P54132 1/20 0.42
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 1/20 0.40
PTK2B Q14289 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39

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
SCHEMBL4103871 0.89 SRC (0.50) TSHRCYP3A4CES2CES1SRC
SCHEMBL157866 0.87 TSHR (0.67) TSHRCYP3A4LMNACES2CES1
SCHEMBL1548804 0.86 TSHR (0.67) TSHRCYP3A4LMNACES2CES1
Fluoride SCHEMBL31047203 0.85 TSHR (0.64) TSHRCYP3A4LMNACES2CES1
SCHEMBL1983846 0.85 TSHR (0.64) TSHRCYP3A4LMNACES2CES1
SCHEMBL8884790 0.85 TSHR (0.64) TSHRCYP3A4LMNACES2CES1
Triphosphate SCHEMBL10709075 0.85 LMNA (0.52) TSHRCYP3A4LMNABTN3A1CES2
SCHEMBL3621404 0.84 TSHR (0.69) TSHRCYP3A4LMNABTN3A1SRC
P-Cresol SCHEMBL3446715 0.83 LTA4H (0.50) TSHRCYP3A4LMNASRCMEN1
SCHEMBL187454 0.83 TSHR (0.67) TSHRCYP3A4LMNASRCBLM

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
WO-2016016851-A1 MELT POLYMERIZED POLYCARBONATE SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2016-02-04 WO disclosed
EP-1720937-A4 CELLULOSE ACYLATE FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY FUJIFILM CORP (JP) 2009-05-27 EP disclosed
US-20070172605-A1 Cellulose acylate film, polarizing plate and liquid crystal display FUJI PHOTO FILM CO., LTD. (JP) 2007-07-26 US disclosed
EP-1720937-A1 CELLULOSE ACYLATE FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY FUJI PHOTO FILM CO., LTD. (JP) 2006-11-15 EP disclosed
WO-2005080482-A1 CELLULOSE ACYLATE FILM, POLARIZING PLATE AND LIQUID CRYSTAL DISPLAY FUJI PHOTO FILM CO., LTD. (JP) 2005-09-01 WO disclosed
CN-1197913-C Flame-retarded resin composition ASAHI CHEMICAL IND (JP) 2005-04-20 CN disclosed
CN-1412246-A Flame-retarded resin composition ASAHI CHEMICAL IND (JP) 2003-04-23 CN disclosed
EP-0345805-A2 Curable polymer composition Kanegafuchi Chemical Industry Co., Ltd. (JP) 1989-12-13 EP disclosed
US-3946053-A ADDITIVES FOR HYDROCARBON FUELS CITIES SERVICE OIL COMPANY (US) 1976-03-23 US disclosed