SCHEMBL8763125

SCHEMBL8763125

O=CN[Si](c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH7 P40394 1/20 0.39
CYP2A6 P11509 1/20 0.38
EPHX1 P07099 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33
THRB P10828 1/20 0.33
BLM P54132 1/20 0.33
TSHR P16473 1/20 0.32
MAPK1 P28482 2/20 0.32
TRPA1 O75762 1/20 0.32
ALOX5 P09917 1/20 0.32
MAPT P10636 1/20 0.31
ESR1 P03372 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
SCHEMBL8763266 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL20792266 0.72 ALDH1A1 (0.42) ALDH1A1ADH1BADH1CADH1AADH7
SCHEMBL146839 0.71 TDP1 (0.35) ALDH1A1MEN1KMT2ALMNATDP1
SCHEMBL8763285 0.70 ADH1B (0.38) ALDH1A1ADH1BADH1CADH1AADH7
SCHEMBL28545159 0.67 ALDH1A1 (0.42) ALDH1A1ADH1BADH1CADH1AADH7
SCHEMBL49919 0.67 TSHR (0.41) ALDH1A1LMNATDP1TAAR1TSHR
SCHEMBL2509044 0.67 TSHR (0.35) ALDH1A1TDP1TSHRMAPK1ESR1
SCHEMBL7761636 0.67 TSHR (0.42) ALDH1A1EPHX1MEN1KMT2ATDP1
SCHEMBL304128 0.65 MAPT (0.37) ALDH1A1ADH1BADH1CADH1AADH7
SCHEMBL49707 0.65 ALDH1A1 (0.43) ALDH1A1EPHX1MEN1KMT2ALMNA

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
EP-0349195-B1 Direct synthesis by cationic polymerization of nitrogen-containing polymers EXXON CHEMICAL PATENTS INC (US) 1997-05-21 EP disclosed
US-5629394-A ENDCAPPING ADDITION POLYMERS WITH NITROGEN FUNCTIONAL GROUPS WHICH CAN BE FURTHER DERIVATIZED EXXON CHEMICAL PATENTS INC (US) 1997-05-13 US disclosed
US-5444135-A Polymerization and functionalization with nitrogen-containing functional groups occur simultaneously EXXON CHEMICAL PATENTS INC. (US) 1995-08-22 US disclosed
US-5336745-A Terminally-substituted polymeric compositions from cationically polymerizable monomers and initiators EXXON CHEMICAL PATENTS INC. (US) 1994-08-09 US disclosed
US-5032653-A Catalysts EXXON CHEMICAL PATENTS, INC. (US) 1991-07-16 US disclosed
EP-0349195-A2 Direct synthesis by cationic polymerization of nitrogen-containing polymers EXXON CHEMICAL PATENTS INC. (US) 1990-01-03 EP disclosed