SCHEMBL13616585

SCHEMBL13616585

C=C(C)C(=O)OCC(=O)OC1C2OC3C1OC(=O)C3C2CC

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL13616586 0.89 TSHR (0.33)
SCHEMBL13011969 0.88
SCHEMBL13616588 0.87 TSHR (0.37)
SCHEMBL13616590 0.87
SCHEMBL13616580 0.86 ALDH1A1 (0.31) ALDH1A1
SCHEMBL11964231 0.84 ALDH1A1 (0.30) ALDH1A1
SCHEMBL13616581 0.84
SCHEMBL12416009 0.82
SCHEMBL13616638 0.81
SCHEMBL14489080 0.80 ALDH1A1 (0.32) ALDH1A1

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