SCHEMBL8030261

SCHEMBL8030261

CCC(CO)(CO)NC(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.62
KMT2A Q03164 5/20 0.61
MEN1 O00255 4/20 0.47
ALDH1A1 P00352 4/20 0.46
LMNA P02545 3/20 0.46
AGTR1 P30556 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TSHR P16473 3/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
MAPK1 P28482 2/20 0.44
BLM P54132 2/20 0.44
ATM Q13315 2/20 0.44
HIF1A Q16665 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
GMNN O75496 1/20 0.44
GABBR2 O75899 1/20 0.44
TP53 P04637 1/20 0.44
CYP2C9 P11712 1/20 0.44

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
SCHEMBL7940420 0.92 GAA (0.53) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL7942322 0.90 GAA (0.51) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL7942429 0.86 GAA (0.45) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL7933918 0.85 GAA (0.67) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL11248800 0.85 GAA (0.67) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL8018893 0.83 HSPA5 (0.49) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL8028524 0.82 GAA (0.41) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL39122 0.79 GAA (0.77) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL4572221 0.79 GAA (0.78) GAAKMT2AMEN1ALDH1A1LMNA
SCHEMBL7248605 0.78 GAA (0.74) GAAKMT2AMEN1ALDH1A1LMNA

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-6075159-A USE AS A STABILIZER FOR AN ORGANIC MATERIAL SUCH AS THERMOPLASTIC RESINS, THERMOSETTING RESINS, NATURAL OR SYNTHETIC RUBBERS, MINERAL OILS, LUBRICATING OILS, ADHESIVES AND PAINTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-06-13 US disclosed
US-5914361-A IMPART HEAT STABILITY TO ORGANIC MATERIALS, INCLUDING POLYOLEFINS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-06-22 US disclosed