SCHEMBL9245665

SCHEMBL9245665

COCC(C)(CO)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
HIF1A Q16665 1/20 0.42
ALDH1A1 P00352 1/20 0.33
NOS1 P29475 1/20 0.30
NOS2 P35228 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
SCHEMBL17914298 0.92 CYP2D6 (0.37) TSHRCYP2D6CYP2C19HIF1A
SCHEMBL889792 0.87 TSHR (0.48) TSHRCYP2D6CYP2C19HIF1AALDH1A1
Methoxymethane SCHEMBL3676990 0.82 TSHR (0.48) TSHRCYP2D6CYP2C19HIF1AALDH1A1
SCHEMBL14581570 0.82 TSHR (0.39) TSHRCYP2D6CYP2C19HIF1AALDH1A1
SCHEMBL2708624 0.81 TSHR (0.42) TSHRCYP2D6CYP2C19HIF1AALDH1A1
SCHEMBL19999961 0.81 GAA (0.33)
SCHEMBL10535565 0.81 DGAT1 (0.38) TSHR
SCHEMBL16000074 0.79 TSHR (0.41) TSHRCYP2D6CYP2C19HIF1AALDH1A1
SCHEMBL19444775 0.79 TSHR (0.41) TSHRCYP2D6CYP2C19HIF1AALDH1A1
SCHEMBL181160 0.79 TSHR (0.55) TSHRCYP2D6CYP2C19HIF1AALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160359195-A1 SOLID ELECTROLYTE COMPOSITION, ELECTRODE SHEET FOR BATTERY AND ALL-SOLID-STATE SECONDARY BATTERY IN WHICH SOLID ELECTROLYTE COMPOSITION IS USED, AND METHOD FOR MANUFACTURING SOLID ELECTROLYTE COMPOSITION FUJIFILM CORPORATION (JP) 2016-12-08 US disclosed
EP-2177357-A2 Negative-working lithographic printing plate precursor and method of lithographic printing using same Fujifilm Corporation (JP) 2010-04-21 EP disclosed
US-5393855-A Containing a 2-oxo-1,3-dioxolan-4-yl group DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-02-28 US disclosed
US-5374699-A Vinyl polymer having 2-oxo-1,3-dioxolan-4-yl group and carboxyl group and a ring opening catalyst; coatings DAINIPPONINK AND CHEMICALS, INC. (JP) 1994-12-20 US disclosed