SCHEMBL11041635

SCHEMBL11041635

CC(C)OC(=O)CO.CC(C)OC(=O)CO.[Zn]

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
LMNA P02545 2/20 0.46
CYP2D6 P10635 1/20 0.37
MAPT P10636 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HCAR2 Q8TDS4 1/20 0.36
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
AGTR1 P30556 1/20 0.33
CA12 O43570 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA7 P43166 3/20 0.32
CA9 Q16790 3/20 0.32
CA14 Q9ULX7 3/20 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
SCHEMBL22558 0.97
SCHEMBL11014727 0.94
Ammonia Solution, Strong SCHEMBL27974201 0.94
SCHEMBL7229497 0.80 TSHR (0.35) TSHRLMNAMAPTSMN1; SMN2TDP1
SCHEMBL7237664 0.80 TSHR (0.35) TSHRLMNAMAPTSMN1; SMN2TDP1
SCHEMBL4812651 0.78
SCHEMBL11133563 0.77 LMNA (0.42) TSHRLMNACYP2D6MAPTALDH1A1
SCHEMBL72471 0.77 LMNA (0.62) TSHRLMNACYP2D6MAPTALDH1A1
SCHEMBL229792 0.77 TSHR (0.50) TSHRLMNACYP2D6MAPTALDH1A1
SCHEMBL1591285 0.76

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
US-4436640-A OIL ADDITIVES; EXTREME PRESSURE LUBRICANTS CHEVRON RESEARCH COMPANY (US) 1984-03-13 US disclosed