SCHEMBL7051743

SCHEMBL7051743

C=CCOCC(O)P(=O)(O)O

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.48
CA2 P00918 5/20 0.48
CA7 P43166 4/20 0.48
CA9 Q16790 4/20 0.41
ALDH1A1 P00352 1/20 0.36
CA4 P22748 3/20 0.34
MPI P34949 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
SCHEMBL1274601 0.80 CA1 (0.55) CA1CA2CA7CA9ALDH1A1
SCHEMBL10404027 0.79 CA1 (0.53) CA1CA2CA7CA9CA4
Phosphoric Acid SCHEMBL1074271 0.78 CA1 (0.47) CA1CA2CA7CA9ALDH1A1
Phosphoric Acid SCHEMBL170152 0.76 CA1 (0.55) CA1CA2CA7CA9ALDH1A1
SCHEMBL28911609 0.75 CA1 (0.44) CA1CA2CA7CA9CA4
Phosphoric Acid SCHEMBL27973227 0.75 CA1 (0.53) CA1CA2CA7CA9CA4
SCHEMBL9285761 0.75 CA1 (0.53) CA1CA2CA7CA9CA4
SCHEMBL28911561 0.75 CA1 (0.44) CA1CA2CA7CA9CA4
Phosphoric Acid SCHEMBL27793397 0.75 CA1 (0.53) CA1CA2CA7CA9CA4
SCHEMBL4563781 0.75 CA1 (0.53) CA1CA2CA7CA9CA4

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-0792275-B1 IMPROVED ANTIVIRAL PRODRUGS UNIV CALIFORNIA (US) 2004-03-03 EP claimed
US-6002029-A Antiviral prodrugs CHIMERIX, INC. 1999-12-14 US claimed