SCHEMBL7896021

SCHEMBL7896021

CC(O)COC(C)COC(C)CO.O=C(O)C1CCC2OC2C1.O=C(O)C1CCC2OC2C1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.31
PPM1B O75688 2/20 0.31
PTPN1 P18031 2/20 0.31
PPP1CC P36873 2/20 0.31

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
SCHEMBL7905306 1.00 TDP1 (0.31) TDP1PPM1BPTPN1PPP1CC
Propylene Glycol SCHEMBL28367917 0.84 TFPI2 (0.38) TDP1PPM1BPTPN1PPP1CC
SCHEMBL7905298 0.82
SCHEMBL7905301 0.82 TDP1 (0.33) TDP1PPM1BPTPN1PPP1CC
SCHEMBL4151786 0.78 TFPI2 (0.38) PPM1BPTPN1PPP1CC
Glycerin SCHEMBL259191 0.76 TFPI2 (0.39) PPM1BPTPN1PPP1CC
SCHEMBL9148281 0.74 TDP1 (0.44) TDP1
SCHEMBL7904274 0.73 TDP1 (0.32) TDP1
Propionic Acid SCHEMBL5351498 0.73 TDP1 (0.47) TDP1
Propionic Acid SCHEMBL6062801 0.73 TDP1 (0.47) TDP1

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-6201070-B1 PROTECTIVE COATINGS WITH CYCLOHEXYLEPOXIDECARBOXYLIC ESTERS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2001-03-13 US disclosed