SCHEMBL7378205

SCHEMBL7378205

CCOC(=O)OC(C)OC(=O)C(=O)OC(C)OC(C)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SOAT1 P35610 1/20 0.41
TSHR P16473 4/20 0.38
MAPT P10636 2/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
TBXA2R P21731 1/20 0.34
GLO1 Q04760 1/20 0.34
GALR3 O60755 1/20 0.33
BLM P54132 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
ALOX15 P16050 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32

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
SCHEMBL7602589 0.94 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10SOAT1TSHR
SCHEMBL7604426 0.94 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10SOAT1TSHR
SCHEMBL5988339 0.94 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10SOAT1TSHR
SCHEMBL28404629 0.85 ALDH1A1 (0.60) ALDH1A1LMNAHSD17B10SOAT1TSHR
SCHEMBL15635452 0.85 ALDH1A1 (0.41) ALDH1A1LMNAHSD17B10SOAT1TSHR
SCHEMBL8452666 0.83 TSHR (0.46) ALDH1A1LMNAHSD17B10SOAT1TSHR
SCHEMBL9407076 0.81 TSHR (0.44) ALDH1A1LMNAHSD17B10SOAT1TSHR
SCHEMBL8823319 0.80 ALDH1A1 (0.40) ALDH1A1LMNAHSD17B10SOAT1TSHR
SCHEMBL18256779 0.78 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10SOAT1TSHR
SCHEMBL14504458 0.78 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10SOAT1MAPT

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
EP-0914158-A2 PHARMACEUTICAL COMBINATION CONTAINING A COMPOUND HAVING ANGIOTENSIN II AND ANTAGONISTIC ACTIVITY Takeda Chemical Industries, Ltd. (JP) 1999-05-12 EP disclosed
WO-1997037688-A2 PHARMACEUTICAL COMBINATION CONTAINING A COMPOUND HAVING ANGIOTENSIN II AND ANTAGONISTIC ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-10-16 WO disclosed