SCHEMBL17333368

SCHEMBL17333368

CCOCCOB([O])OCCOCC

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
TSHR P16473 2/20 0.42
THRB P10828 1/20 0.37
CYP3A4 P08684 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
SCHEMBL17333182 0.84 ALDH1A1 (0.36) ALDH1A1TSHRTHRBCYP3A4
SCHEMBL17333208 0.81 CYP3A4 (0.38) TSHRTHRBCYP3A4
SCHEMBL17333307 0.78
SCHEMBL6473556 0.77 ALDH1A1 (0.43) ALDH1A1TSHRTHRB
SCHEMBL19970453 0.74 ALDH1A1 (0.60) ALDH1A1TSHRTHRB
SCHEMBL22247 0.74
SCHEMBL9237981 0.74 ALDH1A1 (0.41) ALDH1A1TSHRTHRB
SCHEMBL17333286 0.73 CA1 (0.33) CYP3A4
SCHEMBL17333371 0.72 ALDH1A1 (0.46) ALDH1A1TSHRTHRB
SCHEMBL28221799 0.72

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-10439252-B2 Electrolyte solution for electrochemical device, and electrochemical device FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-08 US disclosed
US-20150364792-A1 ELECTROLYTE SOLUTION FOR ELECTROCHEMICAL DEVICE, AND ELECTROCHEMICAL DEVICE WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2015-12-17 US disclosed