SCHEMBL7944817

SCHEMBL7944817

CCN(CCO)C(=O)CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
LMNA P02545 4/20 0.51
MAPK1 P28482 3/20 0.51
HTT P42858 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPT P10636 2/20 0.51
RECQL P46063 1/20 0.51
KDM4E B2RXH2 1/20 0.51
HPGD P15428 1/20 0.51
GAA P10253 6/20 0.51
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.43
HMGCR P04035 1/20 0.42
TSHR P16473 3/20 0.42
AGTR1 P30556 1/20 0.41
GSR P00390 2/20 0.41
CYP1A2 P05177 2/20 0.41
CYP3A4 P08684 2/20 0.41
BLM P54132 2/20 0.41
ATM Q13315 2/20 0.41

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
SCHEMBL13917314 0.93 ALDH1A1 (0.55) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7941050 0.92 HSPA5 (0.46) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7944763 0.92 GAA (0.44) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7943239 0.86 HSP90AA1 (0.51) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7933578 0.83 ALDH1A1 (0.54) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7942923 0.83 HSPA5 (0.49) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7933599 0.82 ALDH1A1 (0.52) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7940318 0.82 LMNA (0.44) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL7943231 0.78 GAA (0.51) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL501541 0.78 GAA (0.65) ALDH1A1LMNAMAPK1HTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6242514-B1 CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2001-06-05 US disclosed
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