SCHEMBL15868617

SCHEMBL15868617

C=C(C)C(=O)OC(C)(CC)C(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
DGAT1 O75907 1/20 0.35
THRB P10828 1/20 0.35
TSHR P16473 3/20 0.34
GAA P10253 1/20 0.31

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
SCHEMBL8377560 0.85 ALDH1A1 (0.45) ALDH1A1DGAT1THRBTSHRGAA
SCHEMBL9643953 0.82 ALDH1A1 (0.42) ALDH1A1DGAT1THRBTSHR
SCHEMBL28404156 0.76 ALDH1A1 (0.43) ALDH1A1DGAT1THRBTSHR
SCHEMBL12100843 0.76 ALDH1A1 (0.52) ALDH1A1DGAT1THRBTSHR
SCHEMBL347723 0.74 ALDH1A1 (0.42) ALDH1A1THRBTSHRGAA
SCHEMBL27543559 0.74 ALDH1A1 (0.68) ALDH1A1THRBTSHRGAA
SCHEMBL1108024 0.74 TSHR (0.43) ALDH1A1THRBTSHRGAA
SCHEMBL2234565 0.74 ALDH1A1 (0.42) ALDH1A1THRBTSHRGAA
SCHEMBL7197082 0.73 DGAT1 (0.39) ALDH1A1DGAT1TSHRGAA
SCHEMBL10299089 0.73 ALDH1A1 (0.48) ALDH1A1DGAT1TSHR

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-9493600-B2 Polymer, surface hydrophilizing agent containing said polymer, and manufacturing method for substrate having hydrophilic surface JSR CORPORATION (JP) 2016-11-15 US disclosed
US-20140194557-A1 NEW POLYMER, SURFACE HYDROPHILIZING AGENT CONTAINING SAID POLYMER, AND MANUFACTURING METHOD FOR SUBSTRATE HAVING HYDROPHILIC SURFACE JSR CORPORATION (JP) 2014-07-10 US disclosed