SCHEMBL11205480

SCHEMBL11205480

O=C1CCCCC(C(CO)(CO)CO)O1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.38
CA9 Q16790 2/20 0.38
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL1987107 0.77 CA1 (0.33) CA1CA9
SCHEMBL6346884 0.76 CA1 (0.40) CA1CA9
SCHEMBL7024923 0.74 CA1 (0.35) CA1CA9
SCHEMBL13533896 0.74 CA1 (0.46) CA1CA9
SCHEMBL13817904 0.74 CA1 (0.46) CA1CA9
SCHEMBL22166739 0.72 CYP1A2 (0.38) CA1CA9LMNATSHR
SCHEMBL3336751 0.72 CA1 (0.37) CA1CA9LMNATSHR
SCHEMBL7021165 0.71
SCHEMBL6357100 0.69 CA1 (0.41) CA1CA9
SCHEMBL1013194 0.69

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
EP-0081984-A1 Method of reduction of discoloration of aromatic peroxide initiated polyol (allyl carbonate) polymers and polymers produced thereby PPG INDUSTRIES, INC. (US) 1983-06-22 EP disclosed