SCHEMBL6720167

SCHEMBL6720167

CC(COc1cccc(OCC(C)OC2CO2)c1)OC1CO1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.49
TSHR P16473 2/20 0.49
HIF1A Q16665 2/20 0.49
ALDH1A1 P00352 1/20 0.49
TP53 P04637 1/20 0.49
CYP3A4 P08684 1/20 0.49
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
MAPK1 P28482 2/20 0.40
MTNR1A P48039 3/20 0.38
MTNR1B P49286 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TRIM24 O15164 1/20 0.38
GAA P10253 1/20 0.38
ACE2 Q9BYF1 1/20 0.37
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.36

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
SCHEMBL6720168 0.82 HPGD (0.38) TSHRHIF1AALDH1A1TP53CYP3A4
SCHEMBL6720171 0.79 LTA4H (0.37) TSHRHIF1AALDH1A1TP53L3MBTL1
SCHEMBL4818360 0.77 KMT2A (0.55) SMN1; SMN2TSHRHIF1AALDH1A1TP53
SCHEMBL6720166 0.70
SCHEMBL2967940 0.70 TRIM24 (0.55) SMN1; SMN2TSHRHIF1AHTR1DHTR1B
SCHEMBL8509600 0.70 SMN1; SMN2 (0.51) SMN1; SMN2TSHRHIF1AALDH1A1TP53
SCHEMBL12444800 0.70 ALDH1A1 (0.69) SMN1; SMN2TSHRHIF1AALDH1A1TP53
SCHEMBL23419306 0.68 MAPK1 (0.42) ALDH1A1MAPK1L3MBTL1KDM4ELMNA
SCHEMBL1241813 0.67 LMNA (0.73) SMN1; SMN2TSHRHIF1ATP53HTR1D
SCHEMBL9053577 0.67 SCN4A (0.57) TSHRHIF1ATP53CYP3A4MAPK1

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-9303114-B2 One liquid type cyanate ester-epoxy composite resin composition ADEKA CORPORATION (JP) 2016-04-05 US disclosed
US-20120123082-A1 ONE LIQUID TYPE CYANATE ESTER-EPOXY COMPOSITE RESIN COMPOSITION ADEKA CORPORATION (JP) 2012-05-17 US disclosed