SCHEMBL1970550

SCHEMBL1970550

CC=CC(=O)OCCCC(OCCOC)OCCOC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.42
HCAR2 Q8TDS4 4/20 0.38
GSTP1 P09211 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TSHR P16473 2/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 2/20 0.32
CYP3A4 P08684 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MET P08581 1/20 0.30
ALOX5 P09917 1/20 0.30
AKR1B10 O60218 1/20 0.30
AKR1B1 P15121 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9717981 0.85 ATM (0.52) ATMHCAR2GSTP1MAPTRAB9A
SCHEMBL1973150 0.84 TSHR (0.52) ATMHCAR2TSHRHPGDALDH1A1
SCHEMBL4956708 0.83 ATM (0.48) ATMHCAR2GSTP1MAPTRAB9A
SCHEMBL4958416 0.83 ATM (0.47) ATMHCAR2GSTP1MAPTRAB9A
SCHEMBL7899872 0.80 ATM (0.45) ATMHCAR2GSTP1MAPTRAB9A
SCHEMBL11572843 0.80 ATM (0.45) ATMHCAR2GSTP1MAPTRAB9A
SCHEMBL3917255 0.79 ATM (0.38) ATMHCAR2MAPTRAB9ANPSR1
Ammonia Solution, Strong SCHEMBL27732612 0.79 ATM (0.43) ATMHCAR2GSTP1MAPTRAB9A
SCHEMBL4967675 0.78 ATM (0.48) ATMHCAR2GSTP1MAPTRAB9A
SCHEMBL4967684 0.78 ATM (0.48) ATMHCAR2GSTP1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2334690-A1 METHOD FOR PRODUCING (METH)ACRYLOSILANES Wacker Chemie AG (DE) 2011-06-22 EP disclosed