SCHEMBL9015597

SCHEMBL9015597

CC(C)(C)OOOC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
RECQL P46063 1/20 0.45
GLRA3 O75311 1/20 0.44
GLRB P48167 1/20 0.44
ALOX5 P09917 2/20 0.43
PTGS1 P23219 2/20 0.43
PTGS2 P35354 2/20 0.43
CA2 P00918 3/20 0.42
CA1 P00915 2/20 0.42
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
POLB P06746 1/20 0.41
TYR P14679 1/20 0.41
GAA P10253 2/20 0.41
TNFRSF1A P19438 1/20 0.40
MEN1 O00255 2/20 0.39

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
SCHEMBL9015752 0.86 LMNA (0.53) LMNARECQLGLRA3GLRBALOX5
SCHEMBL9015746 0.84 LMNA (0.48) LMNARECQLGLRA3GLRBALOX5
SCHEMBL9015650 0.80 LMNA (0.49) LMNARECQLGLRA3GLRBALOX5
SCHEMBL11611460 0.79 LMNA (0.50) LMNARECQLGLRA3GLRBALOX5
SCHEMBL9015607 0.79 LMNA (0.44) LMNARECQLGLRA3GLRBALOX5
SCHEMBL9015694 0.78 LMNA (0.39) LMNARECQLGLRA3GLRBALOX5
SCHEMBL755528 0.77 GAA (0.59) LMNARECQLGLRA3GLRBALOX5
SCHEMBL8108990 0.76 TSHR (0.62) LMNACA2CA1ALDH1A1TDP1
SCHEMBL19176394 0.75 LMNA (0.50) LMNARECQLGLRA3GLRBALOX5
SCHEMBL9015633 0.74 GAA (0.54) LMNAALDH1A1SMN1; SMN2TSHRNPSR1

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-5516856-A IMPROVED PROCESS FOR THE MODIFICATION OF THE MOLECULAR CHAIN OF A POLYMER ELF ATOCHEM NORTH AMERICA, INC. (US) 1996-05-14 US disclosed
US-5051531-A As polymerization catalysts and for crosslinking ATOCHEM NORTH AMERICA, INC. (US) 1991-09-24 US disclosed