SCHEMBL7698331

SCHEMBL7698331

C=CC(=O)OCC[Si](C)(C)Cl

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.52
ALDH1A1 P00352 4/20 0.52
TP53 P04637 3/20 0.52
HIF1A Q16665 3/20 0.52
CYP3A4 P08684 2/20 0.52
HSD17B10 Q99714 1/20 0.52
HPGD P15428 1/20 0.52
THRB P10828 2/20 0.43
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ATM Q13315 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31

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
SCHEMBL691353 0.89 TSHR (0.59) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL9805672 0.88 TSHR (0.52) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL15477579 0.87 TSHR (0.62) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23322030 0.85 TSHR (0.66) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23322250 0.85 TSHR (0.66) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23321537 0.85 TSHR (0.66) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23321980 0.85 TSHR (0.66) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23321525 0.85 TSHR (0.66) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23321986 0.85 TSHR (0.66) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL23321803 0.85 TSHR (0.66) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6344521-B1 LIVING POLYMERS FMC CORPORATION 2002-02-05 US disclosed
US-6271330-B1 POLYSILOXANES, TELECHELIC POLYMERS AND LIVING POLYMERS WITH FREE RADICAL CATALYST FMC CORPORATION 2001-08-07 US disclosed
US-6031060-A INCLUDES PROTECTED, FUNCTIONALIZED SILICONE POLYMERS, SUCH AS MONO-FUNCTIONAL, HOMOTELECHELIC, HETEROTELECHELIC, MACROMONOMER, AND RADIAL POLYMERS FMC CORPORATION (US) 2000-02-29 US disclosed
US-6020430-A LIVING POLYMERS FMC CORPORATION (US) 2000-02-01 US disclosed
US-5554706-A LOW TEMPERATURE LIQUID CRYSTALS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-09-10 US disclosed
EP-0695770-A1 COPOLYMER HAVING LIQUID CRYSTAL GROUP IN THE SIDE CHAIN SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-02-07 EP disclosed