SCHEMBL8630260

SCHEMBL8630260

CCOC(=O)c1ccoc1[Si](C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
ALDH1A1 P00352 7/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
MAPT P10636 2/20 0.49
TP53 P04637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
HPGD P15428 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HSD17B10 Q99714 2/20 0.45
CA12 O43570 4/20 0.44
CA1 P00915 4/20 0.44
CA2 P00918 4/20 0.44
CA7 P43166 4/20 0.44
CA9 Q16790 4/20 0.44
CA14 Q9ULX7 4/20 0.44
PKM P14618 1/20 0.43
CYP1A2 P05177 1/20 0.43
NUDT1 P36639 1/20 0.43
MAOB P27338 1/20 0.43

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
SCHEMBL1757222 0.80 ALDH1A1 (0.60) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL158238 0.79 TSHR (0.55) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL17223287 0.79 TSHR (0.55) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL6260229 0.77 TSHR (0.53) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL4123607 0.77 ALDH1A1 (0.54) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL8635719 0.77 ALDH1A1 (0.53) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL8628117 0.77 TSHR (0.53) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL20337837 0.76 TSHR (0.52) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL6977127 0.75 ALDH1A1 (0.51) TSHRALDH1A1MEN1KMT2AMAPT
SCHEMBL3535217 0.75 TSHR (0.50) TSHRALDH1A1MEN1KMT2AMAPT

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
US-5840917-A ADMINISTERING TO MAMMAL TO ERADICATE HELICOBACTER PYLORI TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-11-24 US disclosed
WO-1998042347-A1 PHARMACEUTICAL COMPOSITION CONTAINING A PHOSPHORYLAMIDE AND AN AYNTIBIOTIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-10-01 WO disclosed
EP-0852498-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE Takeda Chemical Industries, Ltd. (JP) 1998-07-15 EP disclosed
WO-1997011705-A1 PHOSPHORYLAMIDES, THEIR PREPARATION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-04-03 WO disclosed