SCHEMBL3797003

SCHEMBL3797003

COCC(C)OOC(C)=O.[Zn]

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
GALR3 O60755 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL4463122 0.84 TDP1 (0.32) TSHRALDH1A1KDM4EMEN1HPGD
SCHEMBL3797009 0.77 TSHR (0.50) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL28886281 0.75 MMP1 (0.37) TSHRALDH1A1
SCHEMBL3249555 0.75
SCHEMBL3255632 0.75
SCHEMBL23294918 0.75 TSHR (0.52) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL15667 0.75
SCHEMBL446240 0.75
Ammonia Solution, Strong SCHEMBL22607978 0.73 TSHR (0.50) TSHRCHRM2CHRM4CHRM1TBXA2R
Methyl Alcohol SCHEMBL157460 0.73 TSHR (0.50) TSHRCHRM2CHRM4CHRM1TBXA2R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236277-B2 Process for producing nanoparticles 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-08-07 US disclosed
US-20100008847-A1 PROCESS FOR PRODUCING NANOPARTICLES 3M INNOVATIVE PROPERTIES COMPANY 2010-01-14 US disclosed