SCHEMBL1729949

SCHEMBL1729949

CC(C)(C)OC(=O)ON1CC(=O)O[C@H](c2ccccc2)[C@@H]1c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37
ABCB1 P08183 1/20 0.36
GAA P10253 2/20 0.36
ALDH1A1 P00352 4/20 0.35
ATM Q13315 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RIPK1 Q13546 2/20 0.34
KDM4E B2RXH2 1/20 0.34
RORC P51449 1/20 0.34
KMT2A Q03164 1/20 0.34
ELANE P08246 1/20 0.34
KDM1A O60341 1/20 0.33
MAOB P27338 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
NR1H2 P55055 1/20 0.33

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
SCHEMBL894291 0.81 NR1H2 (0.42) USP2TSHRABCB1RORCKMT2A
SCHEMBL894292 0.81 NR1H2 (0.42) USP2TSHRABCB1RORCKMT2A
SCHEMBL3706217 0.81 NR1H2 (0.42) USP2TSHRABCB1RORCKMT2A
SCHEMBL10207129 0.72 POLB (0.49) USP2TSHRABCB1GAAALDH1A1
SCHEMBL7900809 0.71 GAA (0.40) USP2TSHRGAAALDH1A1CYP2C9
SCHEMBL9235945 0.71 GAA (0.40) USP2TSHRGAAALDH1A1CYP2C9
SCHEMBL6822684 0.71 GAA (0.40) USP2TSHRGAAALDH1A1CYP2C9
SCHEMBL3728141 0.71 GAA (0.40) USP2TSHRGAAALDH1A1CYP2C9
SCHEMBL1728421 0.71 RIPK1 (0.34) TSHRABCB1GAAALDH1A1RIPK1
SCHEMBL1728236 0.71 RIPK1 (0.34) TSHRABCB1GAAALDH1A1RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651653-B1 NOVEL CYANO THIAZOLIDES, METHODS FOR THE PRODUCTION THEREOF, AND USE THEREOF AS A MEDICAMENT SANOFI AVENTIS DEUTSCHLAND (DE) 2011-11-23 EP disclosed