SCHEMBL8558409

SCHEMBL8558409

COC(=O)C(C)CP(=O)(OC)OC

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.37
CA14 Q9ULX7 3/20 0.34
CA12 O43570 3/20 0.32
MMP1 P03956 2/20 0.32
MMP2 P08253 2/20 0.32
MMP3 P08254 1/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
ESRRB O95718 1/20 0.31
KYNU Q16719 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
CA7 P43166 1/20 0.30
ALDH1A1 P00352 1/20 0.30
BCHE P06276 1/20 0.30
HIF1A Q16665 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
SCHEMBL8558408 1.00 SMN1; SMN2 (0.37) SMN1; SMN2CA14CA12MMP1MMP2
SCHEMBL15259072 0.81 MMP1 (0.35) SMN1; SMN2CA14CA12MMP1MMP2
SCHEMBL8565444 0.80 SMN1; SMN2 (0.38) SMN1; SMN2CA14CA12MMP1MMP2
SCHEMBL2466027 0.80 MMP1 (0.38) SMN1; SMN2CA14CA12MMP1MMP2
SCHEMBL8558146 0.80 SMN1; SMN2 (0.38) SMN1; SMN2CA14CA12MMP1MMP2
SCHEMBL5456859 0.80 MMP1 (0.38) SMN1; SMN2CA14CA12MMP1MMP2
SCHEMBL8565442 0.80 SMN1; SMN2 (0.38) SMN1; SMN2CA14CA12MMP1MMP2
SCHEMBL11159927 0.80 GABRR1 (0.38)
SCHEMBL28261701 0.78 PGD (0.31)
SCHEMBL2403902 0.78 GABRR1 (0.39) SMN1; SMN2CA14CA12MMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5739373-A Optically active phosphono analogs of succinates and synthesis thereof MONSANTO COMPANY (US) 1998-04-14 US claimed
US-5473092-A Synthesis of optically-active phosphono analogs of succinates MONSANTO COMPANY (US) 1995-12-05 US claimed
US-4623672-A FIREPROOF INSULATION FOR ROOFS BAYER AKTIENGESELLSCHAFT (DE) 1986-11-18 US claimed
EP-0091525-A2 Phosphonoalkanoylamino acids ANALYTICAL RESEARCH PHARMACEUTICALS PTY. LTD. (AU) 1983-10-19 EP disclosed
EP-0070131-A1 Phosphonoalkanoylamino acids ANALYTICAL RESEARCH PHARMACEUTICALS PTY. LTD. (AU) 1983-01-19 EP disclosed