SCHEMBL10169745

SCHEMBL10169745

C=C(C)C(=O)OCC1CCC(COC(=O)C(C)(C)CC)C(O)C1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
HMGCR P04035 3/20 0.36
THRB P10828 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
SCHEMBL8927074 0.83 HMGCR (0.32) ALDH1A1HMGCR
SCHEMBL8927037 0.83 ALDH1A1 (0.37) ALDH1A1THRB
SCHEMBL11304961 0.83 HMGCR (0.36) ALDH1A1HMGCRTHRB
SCHEMBL12255007 0.83 ALDH1A1 (0.38) ALDH1A1THRB
SCHEMBL14826610 0.79 HMGCR (0.41) HMGCR
SCHEMBL20024442 0.78 HMGCR (0.39) HMGCR
SCHEMBL10064107 0.76 ALDH1A1 (0.49) ALDH1A1THRB
SCHEMBL10040758 0.76 ALDH1A1 (0.49) ALDH1A1THRB
SCHEMBL13829224 0.76 HMGCR (0.41) HMGCR
SCHEMBL16938742 0.75 ALDH1A1 (0.36) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101332-B2 Negative-working lithographic printing plate precursor and method of lithographic printing using same FUJIFILM CORPORATION (JP) 2012-01-24 US disclosed
US-20090246688-A1 NEGATIVE-WORKING LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF LITHOGRAPHIC PRINTING USING SAME FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed