SCHEMBL7833013

SCHEMBL7833013

C=CCOC[C@H](CO)OP(=O)(O)C(=O)OP(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.30

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
SCHEMBL8015659 0.84 CA1 (0.35) CA1CA2CA7CA9
SCHEMBL2525977 0.83 CA1 (0.39) CA1CA2CA7CA9
SCHEMBL170149 0.83 CA1 (0.39) CA1CA2CA7CA9
SCHEMBL8722298 0.77 CA1 (0.37) CA1CA2CA7CA9
Choline SCHEMBL16267506 0.75 MEN1 (0.32) CA1CA2CA7
Foscarnet SCHEMBL8455927 0.71 CA1 (0.34) CA1CA2CA7CA9
SCHEMBL8957176 0.70 P2RY10 (0.41)
SCHEMBL28412357 0.69 CA1 (0.38) CA1CA2CA7CA9
SCHEMBL958656 0.69 LPAR3 (0.40) CA1CA2CA7CA9
SCHEMBL8957262 0.69 GPR174 (0.41)

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-0674646-B1 LIPID DERIVATIVES OF PHOSPHONOACIDS FOR LIPOSOMAL INCORPORATION AND METHOD OF USE CHIMERIX INC (US) 2001-10-04 EP claimed
US-5463092-A Viricides VESTAR, INC. (US) 1995-10-31 US claimed