SCHEMBL23045008

SCHEMBL23045008

CCCCCCCCCCCCCCCCC(C)([SiH3])OCC

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
GGPS1 O95749 6/20 0.34
SMPD1 P17405 4/20 0.34
FDPS P14324 9/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CES2 O00748 1/20 0.32
LPAR1 Q92633 1/20 0.32
LPAR3 Q9UBY5 1/20 0.32

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
SCHEMBL27604204 0.79 TSHR (0.38) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL4232575 0.79 TSHR (0.38) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL6889414 0.79 TSHR (0.38) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL29124493 0.79 TSHR (0.38) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL21723155 0.79 TSHR (0.38) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL21472951 0.76 TSHR (0.40) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL14778722 0.76 TSHR (0.40) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL22903055 0.76 TSHR (0.40) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL22903085 0.76 TSHR (0.40) TSHRTHRBGGPS1SMPD1FDPS
SCHEMBL14778895 0.76 TSHR (0.40) TSHRTHRBGGPS1SMPD1FDPS

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
WO-2021037349-A1 MULTI-COMPONENT CROSSLINKABLE MATERIALS BASED ON ORGANYLOXYSILANE-TERMINATED POLYMERS AND EPOXY-FUNCTIONAL COMPOUNDS WACKER CHEMIE AG (DE) 2021-03-04 WO disclosed