SCHEMBL10539079

SCHEMBL10539079

CCOC(=O)C(C)=CO.[KH]

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.50
ALDH1A1 P00352 6/20 0.46
LMNA P02545 2/20 0.46
HSD17B10 Q99714 1/20 0.46
NPSR1 Q6W5P4 2/20 0.45
TRPA1 O75762 1/20 0.41
MAPT P10636 2/20 0.41
CYP2D6 P10635 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP2C19 P33261 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
S1PR4 O95977 1/20 0.39
S1PR1 P21453 1/20 0.39
MAPK1 P28482 1/20 0.39
TSHR P16473 2/20 0.39
ALOX15 P16050 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39

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
SCHEMBL79140 0.98
SCHEMBL8306704 0.98
SCHEMBL2346338 0.98
SCHEMBL5390016 0.95 GLO1 (0.50) GLO1ALDH1A1LMNAHSD17B10NPSR1
SCHEMBL5390019 0.95 GLO1 (0.50) GLO1ALDH1A1LMNAHSD17B10NPSR1
Sulfuric Acid SCHEMBL10523508 0.92 GLO1 (0.44) GLO1ALDH1A1LMNAHSD17B10NPSR1
Sulfuric Acid SCHEMBL9812143 0.89 GLO1 (0.45) GLO1ALDH1A1LMNAHSD17B10NPSR1
Sulfuric Acid SCHEMBL10825566 0.87 GLO1 (0.44) GLO1ALDH1A1LMNAHSD17B10NPSR1
SCHEMBL13934052 0.84 GLO1 (0.48) GLO1ALDH1A1LMNAHSD17B10NPSR1
SCHEMBL6274167 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4877533-A PERVAPORATION; MEMBRANE WITH ACTIVE LAYER OF POLYUNSATURATED ACID OR SALT BRITISH PETROLEUM COMPANY P.L.C. (GB) 1989-10-31 US disclosed
EP-0190212-A1 SEPARATION OF WATER FROM ORGANIC FLUIDS. BRITISH PETROLEUM CO PLC (GB) 1986-08-13 EP disclosed
WO-1986000819-A1 SEPARATION OF WATER FROM ORGANIC FLUIDS THE BRITISH PETROLEUM COMPANY P.L.C. (GB) 1986-02-13 WO disclosed