SCHEMBL8978852

SCHEMBL8978852

CCC[Si](CCC)(OC(C)(C)c1ccccc1)OC(C)(C)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.48
ALDH1A1 P00352 2/20 0.45
ALOX15 P16050 1/20 0.45
TAAR1 Q96RJ0 1/20 0.36
KCNN4 O15554 1/20 0.35
CYP2C19 P33261 2/20 0.33
HIF1A Q16665 1/20 0.33
ESR1 P03372 2/20 0.31
ESR2 Q92731 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
NR3C2 P08235 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPT P10636 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
SCHEMBL15401877 0.80 MAPK1 (0.44) MAPK1ALDH1A1ALOX15TAAR1KCNN4
SCHEMBL28235871 0.73 MAPK1 (0.37) MAPK1ALDH1A1ALOX15
Butane SCHEMBL365415 0.73 MAPK1 (0.81) MAPK1ALDH1A1ALOX15TAAR1KCNN4
SCHEMBL28518052 0.72 MAPK1 (0.47) MAPK1ALDH1A1ALOX15TAAR1KCNN4
SCHEMBL1224411 0.71 MAPK1 (0.56) MAPK1ALDH1A1ALOX15TAAR1KCNN4
SCHEMBL27943115 0.70 MAPK1 (0.45) MAPK1ALDH1A1ALOX15TAAR1KCNN4
Propane SCHEMBL481265 0.70 MAPK1 (0.85) MAPK1ALDH1A1ALOX15TAAR1KCNN4
Pentane SCHEMBL27666632 0.69 MAPK1 (0.74) MAPK1ALDH1A1ALOX15TAAR1KCNN4
SCHEMBL28990191 0.69 MAPK1 (0.44) MAPK1ALDH1A1ALOX15TAAR1KCNN4
SCHEMBL43427 0.69 MAPK1 (0.58) MAPK1ALDH1A1ALOX15TAAR1KCNN4

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-0455313-B1 Process for polymerization of olefins and polymerization catalyst MITSUI PETROCHEMICAL IND (JP) 1996-05-08 EP disclosed
EP-0455313-A1 Process for polymerization of olefins and polymerization catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-11-06 EP disclosed
US-5028671-A Using coordination catalyst contining magnesium, titanium, halogen compounds with organoaluminum and organosilicon compounds MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1991-07-02 US disclosed
EP-0282341-A1 Process for polymerization of olefins and polymerization catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1988-09-14 EP disclosed