SCHEMBL8997142

SCHEMBL8997142

C=CCc1cccc(C)c1O[Si](C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.41
ADRA2B P18089 1/20 0.41
ADRA2C P18825 1/20 0.41
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.35
HSD17B10 Q99714 1/20 0.35
SCN4A P35499 5/20 0.35
CYP3A4 P08684 3/20 0.35
LMNA P02545 2/20 0.35
SCN1A P35498 2/20 0.35
SCN5A Q14524 2/20 0.35
SCN9A Q15858 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 2/20 0.35
NFKB1 P19838 2/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL10790494 0.82 GABRA1 (0.44) ADRA2AADRA2BADRA2CGABRA1GABRB2
SCHEMBL5586090 0.78 GABRA1 (0.41) ADRA2AADRA2BADRA2CGABRA1GABRB2
SCHEMBL5547437 0.77 GABRA1 (0.40) ADRA2AADRA2BADRA2CGABRA1GABRB2
SCHEMBL9715056 0.74 KDM4E (0.51) GABRA1GABRB2GAAMEN1KMT2A
SCHEMBL985213 0.74 TSHR (0.44) ADRA2AADRA2BADRA2CGABRA1GABRB2
SCHEMBL9356930 0.74 ALDH1A1 (0.49) ADRA2AADRA2BADRA2CGABRA1GABRB2
SCHEMBL8961940 0.74 ALDH1A1 (0.47) ADRA2AADRA2BADRA2CKDM4ELMNA
SCHEMBL29699897 0.74 ALDH1A1 (0.47) ADRA2AADRA2BADRA2CKDM4ELMNA
SCHEMBL9625893 0.73 ALDH1A1 (0.43) ADRA2AADRA2BADRA2CKDM4ELMNA
SCHEMBL7805020 0.73 PTGER4 (0.53) GAAKDM4ESCN4AMAPTL3MBTL1

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
EP-0530442-B1 Process for producing a hydroxy-substituted poly (phenylene ether) resin MITSUBISHI CHEM CORP (JP) 1996-09-04 EP disclosed
US-5266673-A Compatibilizer for polymer blends and alloys MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1993-11-30 US disclosed
EP-0530442-A1 Process for producing a hydroxy-substituted poly (phenylene ether) resin MITSUBISHI CHEMICAL CORPORATION (JP) 1993-03-10 EP disclosed
EP-0517017-A2 Thermoplastic resin composition MITSUBISHI CHEMICAL CORPORATION (JP) 1992-12-09 EP disclosed