SCHEMBL10482256

SCHEMBL10482256

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.46
HSD17B10 Q99714 4/20 0.42
MGAM O43451 2/20 0.42
GAA P10253 2/20 0.42
SI P14410 2/20 0.42
MGAM2 Q2M2H8 2/20 0.42
TET2 Q6N021 1/20 0.39
RECQL P46063 2/20 0.38
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
LMNA P02545 3/20 0.33
CA12 O43570 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA2 P00918 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
USP2 O75604 1/20 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
SCHEMBL13502970 0.82 TSHR (0.32) TSHR
SCHEMBL45349 0.80 TSHR (0.48) TSHRHSD17B10MGAMGAASI
SCHEMBL9146934 0.80 TSHR (0.42) TSHRHSD17B10MGAMGAASI
SCHEMBL18334512 0.79 TSHR (0.46) TSHRHSD17B10MGAMGAASI
SCHEMBL5692424 0.79 TSHR (0.46) TSHRHSD17B10MGAMGAASI
SCHEMBL7199767 0.78 GAA (0.48) HSD17B10MGAMGAASIMGAM2
SCHEMBL167149 0.78
SCHEMBL667630 0.78 TSHR (0.50) TSHRHSD17B10MGAMGAASI
SCHEMBL7662459 0.76 HMGCR (0.50) TSHRKDM4EALDH1A1
Ammonia Solution, Strong SCHEMBL3909004 0.76 TSHR (0.48) TSHRHSD17B10MGAMGAASI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4812593-A ZEOLITE CONVERSION OF A TETRALKOXYALKANE OR A DIALKOXYALKANOATE BASF AKTIENGESELLSCHAFT (DE) 1989-03-14 US claimed
CN-102412416-A Nonaqueous electrolyte and nonaqueous electrolyte battery SONY CORP 2012-04-11 CN disclosed
US-4812593-A ZEOLITE CONVERSION OF A TETRALKOXYALKANE OR A DIALKOXYALKANOATE BASF AKTIENGESELLSCHAFT (DE) 1989-03-14 US disclosed
US-4198342-A Method of preparing dihalogen vinyl cyclopropanecarboxylic acid esters DYNAMIT NOBEL ATKIENGESELLSCHAFT (DE) 1980-04-15 US disclosed
US-4198343-A Method of preparing dihalogen vinyl cyclopropanecarboxylic acid esters DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1980-04-15 US disclosed
US-4198341-A 2,5,5-Trimethyl-3-carbalkoxy-4(β,β-dihalovinyl)-4,5-dihydrofurans DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1980-04-15 US disclosed
US-4180446-A Method of preparing dihalogen vinyl cyclopropanecarboxylic acid esters DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) 1979-12-25 US disclosed