SCHEMBL9502919

SCHEMBL9502919

CCC(CC)(OC(CC)(CC)P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FDPS P14324 15/20 0.40
LMNA P02545 1/20 0.36
GGPS1 O95749 7/20 0.36
LPAR3 Q9UBY5 3/20 0.36
LPAR1 Q92633 2/20 0.36
LPAR2 Q9HBW0 2/20 0.36

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
SCHEMBL6830149 0.84 FDPS (0.32) FDPS
SCHEMBL8193965 0.80 FDPS (0.39) FDPSLMNAGGPS1LPAR3LPAR1
SCHEMBL4828598 0.78 FDPS (0.41) FDPSLMNAGGPS1LPAR3LPAR1
SCHEMBL9125627 0.74 FDPS (0.34) FDPSLMNAGGPS1LPAR3LPAR1
SCHEMBL9126175 0.74 FDPS (0.38) FDPSLMNAGGPS1LPAR3LPAR1
SCHEMBL18813385 0.72 LPAR3 (0.34) FDPSGGPS1LPAR3LPAR1LPAR2
SCHEMBL8722288 0.72 PPARD (0.35) FDPSGGPS1LPAR3LPAR1LPAR2
SCHEMBL10700021 0.72 FDPS (0.33) FDPSGGPS1LPAR3LPAR1LPAR2
SCHEMBL3482322 0.71 HCAR2 (0.34) FDPS
SCHEMBL8334216 0.71 FDPS (0.33) FDPSLMNAGGPS1LPAR3LPAR1

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-0550574-A1 HETEROCYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1993-07-14 EP disclosed
WO-1992005180-A1 HETEROCYCLIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1992-04-02 WO disclosed