SCHEMBL17728693

SCHEMBL17728693

CCCCCC[Si](C)(O)O[Si](C)(C)O[Si](C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
THRB P10828 1/20 0.32
LMNA P02545 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
EPHX1 P07099 1/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
LPAR3 Q9UBY5 3/20 0.30
LPAR2 Q9HBW0 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
SCHEMBL19090107 0.90 TSHR (0.36) TSHRTHRBLMNAALDH1A1HSD17B10
SCHEMBL17922751 0.90 TSHR (0.36) TSHRTHRBLMNAALDH1A1HSD17B10
Heptane SCHEMBL2518470 0.82 TSHR (0.47) TSHRTHRBLMNAALDH1A1HSD17B10
SCHEMBL12288169 0.79 TSHR (0.35) TSHRTHRB
SCHEMBL21835638 0.79 TSHR (0.35) TSHRTHRB
SCHEMBL21835634 0.79 TSHR (0.35) TSHRTHRB
SCHEMBL21835636 0.79 TSHR (0.35) TSHRTHRB
SCHEMBL21835666 0.79 TSHR (0.35) TSHRTHRB
SCHEMBL21835664 0.79 TSHR (0.35) TSHRTHRB
SCHEMBL16796700 0.79 TSHR (0.35) TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9951208-B2 Silica shielding agents and related methods BRIDGESTONE CORPORATION (JP) 2018-04-24 US disclosed
US-20160130423-A1 Silica Shielding Agents And Related Methods BRIDGESTONE CORPORATION (JP) 2016-05-12 US disclosed