SCHEMBL2990210

SCHEMBL2990210

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

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.38
HSD17B10 Q99714 1/20 0.38
MMP1 P03956 4/20 0.34
MMP2 P08253 4/20 0.34
MMP8 P22894 2/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
MMP3 P08254 3/20 0.33
MMP9 P14780 2/20 0.33
EPHX1 P07099 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MGAM O43451 2/20 0.32
GAA P10253 2/20 0.32
SI P14410 2/20 0.32
MGAM2 Q2M2H8 2/20 0.32

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
SCHEMBL2982566 0.79 TSHR (0.35) TSHRHSD17B10MMP1MMP2MMP8
SCHEMBL17485939 0.78 TSHR (0.38) TSHRHSD17B10MMP1MMP2MMP8
SCHEMBL2982561 0.76 ALDH1A1 (0.46) TSHRHSD17B10ALDH1A1MGAMGAA
SCHEMBL2976398 0.70 HTT (0.32) TSHRHSD17B10
SCHEMBL2978546 0.70 TSHR (0.42) TSHRMMP1MMP2CA12CA1
Butane SCHEMBL2236209 0.70 MMP2 (0.44) TSHRMMP1MMP2MMP8CA12
SCHEMBL11597415 0.69 MMP2 (0.41) TSHRMMP1MMP2MMP8CA12
SCHEMBL2992934 0.69 ALDH1A1 (0.33) TSHRALDH1A1
SCHEMBL2236212 0.69 CA12 (0.52) TSHRCA12CA1CA2CA9
SCHEMBL2990317 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8962192-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2015-02-24 US disclosed
US-8574757-B2 Nonaqueous electrolytic solution and nonaqueous electrolyte battery MITSUBISHI CHEMICAL CORPORATION (JP) 2013-11-05 US disclosed
CN-102780038-A Nonaqueous electrolyte battery MITSUBISHI CHEM CORP 2012-11-14 CN disclosed
US-20120264011-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2012-10-18 US disclosed
US-20100035147-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTE BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2010-02-11 US disclosed
CN-101622751-A Nonaqueous electrolyte solution and nonaqueous electrolyte battery MITSUBISHI CHEM CORP 2010-01-06 CN disclosed