SCHEMBL6798528

SCHEMBL6798528

COC(=O)[C@@H]1C[C@@H](O[Si](C)(C)C)CN1C(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
MITF O75030 1/20 0.44
MAPT P10636 1/20 0.44
HTT P42858 1/20 0.44
PREP P48147 3/20 0.44
FKBP1A P62942 1/20 0.43
NPSR1 Q6W5P4 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTR2C P28335 1/20 0.41
CPB1 P15086 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL28616119 1.00 POLB (0.46) POLBMITFMAPTHTTPREP
SCHEMBL28611699 1.00 POLB (0.46) POLBMITFMAPTHTTPREP
SCHEMBL820714 0.89 POLB (0.43) POLBMITFMAPTHTTPREP
SCHEMBL20666655 0.89 POLB (0.43) POLBMITFMAPTHTTPREP
SCHEMBL114481 0.89 POLB (0.43) POLBMITFMAPTHTTPREP
SCHEMBL28747 0.89 POLB (0.43) POLBMITFMAPTHTTPREP
SCHEMBL9640980 0.89 POLB (0.43) POLBMITFMAPTHTTPREP
SCHEMBL15399080 0.89 POLB (0.43) POLBMITFMAPTHTTPREP
SCHEMBL819017 0.89 POLB (0.43) POLBMITFMAPTHTTPREP
SCHEMBL2999647 0.89 POLB (0.49) POLBMITFMAPTHTTPREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6833456-B2 Heterocyclic sulfides such as 5-(2-(2R-Hydroxymethyl-pyrrolidine-1-carbonyl)-thieno(3,2-b)pyridin-7 -ylamino)-2-methyl-indole-1-carboxylic acid methylamide, used as angiogenesis inhibitors AGOURON PHARMACEUTICALS, INC. 2004-12-21 US disclosed