SCHEMBL13616582

SCHEMBL13616582

C=CC(=O)OCC(=O)OC1C2OC3C1OC(=O)C3C2CCCC

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.35
HPGD P15428 1/20 0.35
PRKCA P17252 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
SCHEMBL13616584 0.96 PRKCA (0.35) TSHRHPGDPRKCA
SCHEMBL13616581 0.89
SCHEMBL13616586 0.85 TSHR (0.33) TSHRPRKCA
SCHEMBL13616579 0.82
SCHEMBL13616591 0.82
SCHEMBL13616588 0.82 TSHR (0.37) TSHRPRKCA
SCHEMBL13630440 0.80 TSHR (0.34) TSHRHPGD
SCHEMBL12130163 0.79
SCHEMBL13616613 0.79
SCHEMBL13616592 0.79 PRKCA (0.33) PRKCA

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-20090286937-A1 CHEMICALLY AMPLIFIED POSITIVE RESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-11-19 US disclosed