SCHEMBL1756480

SCHEMBL1756480

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.35
CACNA2D1 P54289 2/20 0.33
ADRA1A P35348 2/20 0.33
CACNB3 P54284 1/20 0.33
CACNA1C Q13936 1/20 0.33
PGR P06401 1/20 0.33
HTR2B P41595 1/20 0.33
CACNA2D2 Q9NY47 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PGD P52209 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HMGCR P04035 1/20 0.32
CHRM1 P11229 1/20 0.32
TBXA2R P21731 1/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP2D6 P10635 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 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
SCHEMBL21819661 1.00 SLC22A6 (0.35) SLC22A6CACNA2D1ADRA1ACACNB3CACNA1C
SCHEMBL27996315 0.79 SLC22A6 (0.36) SLC22A6CACNA2D1ADRA1ACACNB3CACNA1C
SCHEMBL27714061 0.78 SLC22A6 (0.32) SLC22A6CACNA2D1ADRA1ACACNB3CACNA1C
SCHEMBL8970587 0.75 SLC22A6 (0.41) SLC22A6CACNA2D1ADRA1ACACNB3CACNA1C
SCHEMBL15437626 0.72 LMNA (0.40) SLC22A6CACNA2D1ADRA1ACACNB3CACNA1C
SCHEMBL21819624 0.71 MAPT (0.40) MAPTCYP2C19HIF1A
Hydrochloric Acid SCHEMBL9067525 0.70 SLC22A6 (0.36) SLC22A6CACNA2D1ADRA1ACACNB3CACNA1C
SCHEMBL633699 0.70 PGD (0.39) PGD
SCHEMBL28215085 0.69 TSHR (0.34) PGDTSHR
SCHEMBL5057193 0.69 SLC22A6 (0.39) SLC22A6CACNA2D1ADRA1ACACNB3CACNA1C

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-1591531-B1 PROCESS FOR ACYL-TRANSFER ENZYME REACTIONS WITH ACYL- COENZYME A SHOWA DENKO KK (JP) 2016-03-23 EP disclosed
US-7943351-B2 Method for acyltransferase reaction using acyl coenzyme A SHOWA DENKO K.K. (JP) 2011-05-17 US disclosed
US-20090111153-A1 METHOD FOR ACYLTRANSFERASE REACTION USING ACYL COENZYME A SHOWA DENKO K.K. 2009-04-30 US disclosed
US-7476521-B2 acyl group of acyl coenzyme A is transferred to an acyl group receptor characterized in that the reaction is carried out by production and/or reproduction of acyl coenzyme A from coenzyme A in a reaction system by a chemical thioester exchange reaction with acylthioester SHOWA DENKO K.K. (JP) 2009-01-13 US disclosed
US-20060148048-A1 acyl group of acyl coenzyme A is transferred to an acyl group receptor characterized in that the reaction is carried out by production and/or reproduction of acyl coenzyme A from coenzyme A in a reaction system by a chemical thioester exchange reaction with acylthioester SHOWA DENKO K.K. (JP) 2006-07-06 US disclosed
EP-1591531-A1 PROCESS FOR ACYL-TRANSFER ENZYME REACTIONS WITH ACYL- COENZYME A Showa Denko K.K. (JP) 2005-11-02 EP disclosed