SCHEMBL6270772

SCHEMBL6270772

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

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.38
LDHA P00338 1/20 0.36
SRR Q9GZT4 1/20 0.36
HSD17B10 Q99714 1/20 0.33
MGAM O43451 1/20 0.33
GAA P10253 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
LGALS8 O00214 1/20 0.30
CYP1A2 P05177 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
SCHEMBL8195362 0.95 TSHR (0.38) TSHRLDHASRRHSD17B10MGAM
SCHEMBL6270763 0.87 TSHR (0.41) TSHRHSD17B10MGAMGAASI
SCHEMBL28131763 0.79 MGAM (0.54) TSHRHSD17B10MGAMGAASI
SCHEMBL7053763 0.77 TSHR (0.33) TSHRLDHASRRCYP1A2
SCHEMBL1543387 0.77 THRB (0.42) TSHRLDHASRRMGAMGAA
SCHEMBL9067314 0.76 TSHR (0.54) TSHRHSD17B10MEN1KMT2A
SCHEMBL5888017 0.76 MEN1 (0.33) TSHRLDHASRRGAAMEN1
SCHEMBL242500 0.75 TSHR (0.47) TSHRLDHASRRMEN1KMT2A
SCHEMBL784026 0.75 MEN1 (0.38) TSHRHSD17B10MGAMGAASI
Butane SCHEMBL10826497 0.74 ALOX15 (0.36) TSHRLDHASRRHSD17B10

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-9034661-B2 Method for producing molecule immobilizing substrate, and molecule immobilizing substrate SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-05-19 US disclosed
US-20100233827-A1 METHOD FOR PRODUCING MOLECULE IMMOBILIZING SUBSTRATE, AND MOLECULE IMMOBILIZING SUBSTRATE SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-09-16 US disclosed
US-20050123781-A1 One-component flexible etch resistant clearcoat NIPPON PAINT (USA), INC. 2005-06-09 US disclosed
EP-1538172-A1 One-component flexible etch resistant clearcoat ROHM AND HAAS COMPANY (US) 2005-06-08 EP disclosed