SCHEMBL7704000

SCHEMBL7704000

C[Si](C)(C)O[C@H](C(=O)O)[C@H](O[Si](C)(C)C)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.40
SLC1A2 P43004 1/20 0.40
SLC1A1 P43005 1/20 0.40
TP53 P04637 2/20 0.35
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
MMP13 P45452 1/20 0.34
TSHR P16473 2/20 0.31
LMNA P02545 1/20 0.30
ALDH1A1 P00352 1/20 0.30
THRB P10828 1/20 0.30
RECQL P46063 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
SCHEMBL8909706 1.00 SLC1A3 (0.40) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL7704009 1.00 SLC1A3 (0.40) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL7523930 0.79 TP53 (0.33) SLC1A3SLC1A2SLC1A1TP53
SCHEMBL10011315 0.77 TP53 (0.38) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL8920591 0.77 TDP1 (0.36) SLC1A3SLC1A2SLC1A1MMP1MMP2
SCHEMBL1053131 0.75 SLC1A3 (0.31) SLC1A3SLC1A2SLC1A1TP53
SCHEMBL9730352 0.73 TP53 (0.35) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL10511809 0.73 TP53 (0.35) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL10912827 0.71 SLC1A3 (0.33) SLC1A3SLC1A2SLC1A1
SCHEMBL10476486 0.71 SMN1; SMN2 (0.43) SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0988299-B1 POLYMERISABLE, OPTICALLY ACTIVE DIOXOLANE DIESTERS ROLIC AG (CH) 2002-07-03 EP disclosed
US-6120859-A Polymerisable, optically active dioxolane diesters ROLIC AG (CH) 2000-09-19 US disclosed
EP-0988299-A1 POLYMERISABLE, OPTICALLY ACTIVE DIOXOLANE DIESTERS Rolic AG (CH) 2000-03-29 EP disclosed
WO-1998055473-A1 POLYMERISABLE, OPTICALLY ACTIVE DIOXOLANE DIESTERS ROLIC AG (CH) 1998-12-10 WO disclosed