SCHEMBL5140439

SCHEMBL5140439

CCCCC(CO)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 9/20 0.65
FDPS P14324 15/20 0.54
SMPD1 P17405 2/20 0.45
LPAR1 Q92633 1/20 0.45
LPAR3 Q9UBY5 1/20 0.45
AGTR1 P30556 1/20 0.39
OPRM1 P35372 1/20 0.39
PDE3A Q14432 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
SCHEMBL8332966 0.88 GGPS1 (0.82) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL15876463 0.79 GGPS1 (1.00) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL10486919 0.79 GGPS1 (1.00) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL5066684 0.77 GGPS1 (0.79) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL3264877 0.75 GGPS1 (0.57) GGPS1FDPSSMPD1LPAR1LPAR3
Phosphoric Acid SCHEMBL6263536 0.74 FDPS (0.50) GGPS1FDPSSMPD1LPAR1LPAR3
Phosphoric Acid SCHEMBL27558355 0.74 GGPS1 (0.80) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL11334311 0.73 FDPS (0.60) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL5247235 0.72 GGPS1 (0.65) GGPS1FDPSSMPD1LPAR1LPAR3
SCHEMBL3296415 0.71 FDPS (0.58) GGPS1FDPSSMPD1LPAR1LPAR3

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-1984430-A2 PHOSPHONIC ACID-CONTAINING BLENDS AND PHOSPHONIC ACID-CONTAINING POLYMERS Universität Stuttgart - Institut für Chemische Verfahrenstechnik (DE) 2008-10-29 EP disclosed
WO-2007101415-A2 PHOSPHONIC ACID-CONTAINING BLENDS AND PHOSPHONIC ACID-CONTAINING POLYMERS Universität Stuttgart - Institut für Chemische Verfahrenstechnik (DE) 2007-09-13 WO disclosed