SCHEMBL8743575

SCHEMBL8743575

O=P(O)(O)C(F)(F)CCCO

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.59
LPAR3 Q9UBY5 1/20 0.59
PGK1 P00558 3/20 0.38
PGK2 P07205 3/20 0.38
FDPS P14324 4/20 0.33
PNP P00491 4/20 0.33
PDE3A Q14432 1/20 0.33
GGPS1 O95749 2/20 0.32
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
PTPN6 P29350 1/20 0.31
PTPN11 Q06124 1/20 0.31

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
SCHEMBL1533877 0.78 LPAR1 (0.83) LPAR1LPAR3FDPSGGPS1
SCHEMBL6154740 0.78 LPAR1 (0.57) LPAR1LPAR3PGK1PGK2FDPS
SCHEMBL1533943 0.76 LPAR1 (0.96) LPAR1LPAR3FDPSGGPS1
SCHEMBL15110889 0.76 LPAR1 (0.45) LPAR1LPAR3PGK1PGK2FDPS
SCHEMBL9109027 0.76 LPAR1 (0.61) LPAR1LPAR3PGK1PGK2FDPS
SCHEMBL193245 0.75 LPAR1 (1.00) LPAR1LPAR3FDPSGGPS1
SCHEMBL18720921 0.75 LPAR1 (0.59) LPAR1LPAR3PGK1PGK2FDPS
SCHEMBL9110451 0.75 LPAR1 (0.64) LPAR1LPAR3PGK1PGK2FDPS
SCHEMBL10090904 0.73 LPAR1 (0.42) LPAR1LPAR3PGK1PGK2PTPN2
SCHEMBL1585488 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0335770-B1 Novel fluorophosphonate nucleotide derivatives MERRELL PHARMA INC (US) 1997-01-15 EP disclosed
EP-0335770-A2 Novel fluorophosphonate nucleotide derivatives MERRELL PHARMACEUTICALS INC. (US) 1989-10-04 EP disclosed