SCHEMBL1032912

SCHEMBL1032912

CO[Si](OC)(OC)c1ncc[nH]1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SMPD3 Q9NY59 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ADRA2A P08913 4/20 0.34
ADRA1A P35348 4/20 0.34
ADRA2C P18825 3/20 0.34
ADRA1D P25100 3/20 0.34
ADRA1B P35368 3/20 0.34
NISCH Q9Y2I1 2/20 0.33
MTOR P42345 1/20 0.31
ADK P55263 1/20 0.31
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31
CYP2D6 P10635 2/20 0.31
CYP19A1 P11511 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
MAPT P10636 1/20 0.30
MAPK1 P28482 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
SCHEMBL3174030 0.76 ALDH1A1 (0.38) ALDH1A1SMN1; SMN2NISCHCYP1A2CYP3A4
SCHEMBL207 0.72
SCHEMBL15140518 0.72 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2SMPD3ADRA2AADRA2C
SCHEMBL1374565 0.71 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2KDM4EADRA2AADRA1A
SCHEMBL28418820 0.68
SCHEMBL4964412 0.67 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2NISCHMTORADK
SCHEMBL27125044 0.67 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2ADRA2AADRA2CNISCH
SCHEMBL7049007 0.67 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2NISCHMTORADK
SCHEMBL9737657 0.67 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2NISCHMTORADK
SCHEMBL140714 0.67 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2ADRA2AADRA1AADRA2C

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111250116-B Catalyst, and preparation method and application thereof 中国科学院大连化学物理研究所 2023-04-07 CN claimed
CN-111250116-A Catalyst, and preparation method and application thereof 中国科学院大连化学物理研究所 2020-06-09 CN claimed
CN-111253227-A Preparation method of p-methoxybenzaldehyde from p-methoxytoluene 中国科学院大连化学物理研究所 2020-06-09 CN claimed
CN-111250116-B Catalyst, and preparation method and application thereof 中国科学院大连化学物理研究所 2023-04-07 CN disclosed
US-11028256-B2 Silica-containing rubber compositions containing specified coupling agents and related methods BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC (US) 2021-06-08 US disclosed
CN-111253227-B Preparation method of p-methoxybenzaldehyde from p-methoxytoluene 中国科学院大连化学物理研究所 2021-06-01 CN disclosed
CN-111250116-A Catalyst, and preparation method and application thereof 中国科学院大连化学物理研究所 2020-06-09 CN disclosed
CN-111253227-A Preparation method of p-methoxybenzaldehyde from p-methoxytoluene 中国科学院大连化学物理研究所 2020-06-09 CN disclosed
US-20200123349-A1 SILICA-CONTAINING RUBBER COMPOSITIONS CONTAINING SPECIFIED COUPLING AGENTS AND RELATED METHODS BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC (US) 2020-04-23 US disclosed
US-20170247532-A1 SILICA-CONTAINING RUBBER COMPOSITIONS CONTAINING SPECIFIED COUPLING AGENTS AND RELATED METHODS BRIDGESTONE AMERICAS TIRE OPERATIONS, LLC 2017-08-31 US disclosed
EP-3197950-A1 SILICA-CONTAINING RUBBER COMPOSITIONS CONTAINING SPECIFIED COUPLING AGENTS AND RELATED METHODS Bridgestone Americas Tire Operations, LLC (US) 2017-08-02 EP disclosed
CN-101063001-A Thermoplastic elastomers and composition thereof YOKOHAMA RUBBER CO LTD (JP) 2007-10-31 CN disclosed
EP-1724318-A1 METHOD FOR ADHESIVE-BONDING VULCANIZED RUBBER COMPOSITIONS BY THE USE OF THERMOPLASTIC ELASTOMER COMPOSITIONS THE YOKOHAMA RUBBER CO., LTD. (JP) 2006-11-22 EP disclosed
US-20060213605-A1 Method for adhesive-bonding vulcanized rubber compositions by the use of thermoplastic elastomer compositions YOKOHAMA RUBBER CO., LTD., THE (JP) 2006-09-28 US disclosed
US-20060199917-A1 thermoplastic elastomer exhibiting high recyclability and oil resistance as well as excellent mechanical strength, and in particular, excellent resistance to compression set is provided. The thermoplastic resin with epoxy, hydroxy or nitrogen groups in backbone YOKOHAMA RUBBER CO., LTD., THE (JP) 2006-09-07 US disclosed
EP-1695987-A1 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. (JP) 2006-08-30 EP disclosed
US-20060189755-A1 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. 2006-08-24 US disclosed
US-7067592-B2 Thermoplastic elastomer composition THE YOKOHAMA RUBBER CO., LTD. (JP) 2006-06-27 US disclosed
US-20060094829-A1 Thermoplastic elastomer THE YOKOHAMA RUBBER CO., LTD. 2006-05-04 US disclosed
US-20040106744-A1 Thermoplastic elastomer composition YOKOHAMA RUBBER CO., LTD., THE (JP) 2004-06-03 US disclosed