SCHEMBL4943611

SCHEMBL4943611

CCCCCC(OP(=O)(O)O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.51
CETP P11597 4/20 0.43
PTPN1 P18031 1/20 0.42
FDPS P14324 3/20 0.41
POLB P06746 1/20 0.41
ALDH1A1 P00352 1/20 0.40

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
SCHEMBL27353954 0.98 SMPD1 (0.54) SMPD1CETPPTPN1FDPSALDH1A1
SCHEMBL11234605 0.98 SMPD1 (0.54) SMPD1CETPPTPN1FDPSALDH1A1
SCHEMBL11796536 0.98 SMPD1 (0.54) SMPD1CETPPTPN1FDPSALDH1A1
SCHEMBL10975523 0.98 SMPD1 (0.54) SMPD1CETPPTPN1FDPSALDH1A1
SCHEMBL26655129 0.97 SMPD1 (0.53) SMPD1CETPPTPN1FDPSALDH1A1
SCHEMBL28982716 0.97 SMPD1 (0.53) SMPD1CETPPTPN1FDPSALDH1A1
SCHEMBL28982744 0.97 SMPD1 (0.53) SMPD1CETPPTPN1FDPSALDH1A1
SCHEMBL8435976 0.95 SMPD1 (0.45) SMPD1CETPFDPSPOLBALDH1A1
SCHEMBL6908912 0.88 ALDH1A1 (0.45) SMPD1POLBALDH1A1
SCHEMBL4943604 0.87 SLC7A5 (0.40) SMPD1CETPPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1115170-B1 NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY CELL AND METHOD FOR MANUFACTURING THE SAME PANASONIC CORP (JP) 2008-12-03 EP disclosed
US-6733927-B1 CONTAINING PHOSPHATE ESTER MIXTURE; SUPPRESSING REACTION WITH ELECTRODE DURING HIGH TEMPERATURE STORAGE MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2004-05-11 US disclosed
EP-1115170-A1 NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY CELL AND METHOD FOR MANUFACTURING THE SAME MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2001-07-11 EP disclosed
US-4006204-A ANTIINFLAMMATORY, PROSTAGLANDIN SYNTHETASE INHIBITORS AND RECEPTOR BLOCKERS NELSON RESEARCH & DEVELOPMENT COMPANY (US) 1977-02-01 US disclosed