SCHEMBL8137604

SCHEMBL8137604

CCCCCc1cc(CC(=O)OCCCCCCCCOC(=O)Cc2ccc(O)c(CCCCC)c2)ccc1O

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
YWHAG P61981 1/20 0.52
KAT8 Q9H7Z6 2/20 0.47
CNR2 P34972 2/20 0.45

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
SCHEMBL8131870 0.96 YWHAG (0.56) YWHAGKAT8CNR2
Ethylene SCHEMBL6931741 0.87 THRB (0.46) YWHAGKAT8
SCHEMBL31296591 0.86 YWHAG (0.66) YWHAG
SCHEMBL31296571 0.86 YWHAG (0.66) YWHAG
SCHEMBL31296568 0.86 YWHAG (0.66) YWHAG
SCHEMBL22471786 0.86 YWHAG (0.66) YWHAG
SCHEMBL22471841 0.86 YWHAG (0.66) YWHAG
SCHEMBL22471866 0.86 YWHAG (0.66) YWHAG
SCHEMBL22471820 0.86 YWHAG (0.66) YWHAG
SCHEMBL31296574 0.86 YWHAG (0.66) YWHAG

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-6143860-A Polyketone polymer composition SHELL OIL COMPANY (US) 2000-11-07 US disclosed