SCHEMBL7875149

SCHEMBL7875149

CCC(OC(C)=O)C(CC)OC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.48
TSHR P16473 3/20 0.48
TRPV1 Q8NER1 1/20 0.42
ALDH1A1 P00352 5/20 0.41
LMNA P02545 2/20 0.41
HSD17B10 Q99714 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM1 P11229 1/20 0.41
TBXA2R P21731 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
GALR3 O60755 1/20 0.39
MAPT P10636 1/20 0.39
BLM P54132 1/20 0.39
ALOX15 P16050 1/20 0.37
PGD P52209 1/20 0.36
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
HRH1 P35367 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL17309557 0.88 TDP1 (0.41) TDP1TSHRTRPV1ALDH1A1LMNA
SCHEMBL1698005 0.87 TSHR (0.48) TDP1TSHRTRPV1ALDH1A1LMNA
SCHEMBL1232896 0.87 TSHR (0.48) TDP1TSHRTRPV1ALDH1A1LMNA
SCHEMBL28292460 0.87 TDP1 (0.43) TDP1TSHRTRPV1ALDH1A1LMNA
SCHEMBL16546894 0.86 TDP1 (0.64) TDP1TSHRTRPV1ALDH1A1LMNA
SCHEMBL1473681 0.85 TDP1 (0.42) TDP1TSHRTRPV1ALDH1A1LMNA
SCHEMBL12175911 0.85 TDP1 (0.42) TDP1TSHRTRPV1ALDH1A1LMNA
SCHEMBL7539461 0.85 TSHR (0.46) TDP1TSHRTRPV1ALDH1A1LMNA
SCHEMBL15261665 0.85 TSHR (0.46) TDP1TSHRTRPV1ALDH1A1LMNA
SCHEMBL362428 0.85 TSHR (0.46) TDP1TSHRTRPV1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440300-B2 Coated polyoxymethylenes BASF SE (DE) 2013-05-14 US disclosed
US-8426023-B2 Coated polyoxymethylenes comprising a formaldehyde scavenger comprising a lysine compound BASF SE (DE) 2013-04-23 US disclosed
US-8110010-B2 Coated coloring agents HENKEL AG & CO. KGAA (DE) 2012-02-07 US disclosed
US-8029912-B2 Coated polyoxymethylenes BASF SE (DE) 2011-10-04 US disclosed
US-20100324184-A1 COATED POLYOXYMETHYLENES BASF SE (DE) 2010-12-23 US disclosed
US-20100316865-A1 COATED POLYOXYMETHYLENES BASF SE (DE) 2010-12-16 US disclosed
WO-2010136474-A2 SUBSTITUTED AMINOBUTYRIC DERIVATIVES AS NEPRILYSIN INHIBITORS NOVARTIS AG (CH) 2010-12-02 WO disclosed
US-20100291389-A1 COATED POLYOXYMETHYLENES BASF SE PATENTS, TRADEMARKS AND LICENSES (DE) 2010-11-18 US disclosed