SCHEMBL7905301

SCHEMBL7905301

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

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.33
PPM1B O75688 2/20 0.32
PTPN1 P18031 2/20 0.32
PPP1CC P36873 2/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 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
SCHEMBL7896016 0.90 PPM1B (0.32) PPM1BPTPN1PPP1CC
SCHEMBL13935369 0.84 PPM1B (0.37) PPM1BPTPN1PPP1CCADRB2ADRB1
SCHEMBL12510730 0.84 PPM1B (0.32) PPM1BPTPN1PPP1CC
SCHEMBL12482232 0.83 PPM1B (0.35) PPM1BPTPN1PPP1CCADRB2ADRB1
SCHEMBL7905306 0.82 TDP1 (0.31) TDP1PPM1BPTPN1PPP1CC
SCHEMBL7896021 0.82 TDP1 (0.31) TDP1PPM1BPTPN1PPP1CC
SCHEMBL13935510 0.82 PPM1B (0.37) PPM1BPTPN1PPP1CCADRB2ADRB1
SCHEMBL14619076 0.81
SCHEMBL13935513 0.80 ADRB2 (0.40) PPM1BPTPN1PPP1CCADRB2ADRB1
SCHEMBL14505069 0.80 TSHR (0.39) PPM1BPTPN1PPP1CC

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