SCHEMBL5513040

SCHEMBL5513040

COCc1ccc(C(C)(C)C)c(O)c1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.41
ALDH1A1 P00352 4/20 0.38
PRKCE Q02156 3/20 0.38
MYLK Q15746 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
MEN1 O00255 1/20 0.38
PRKCG P05129 1/20 0.38
MAPT P10636 1/20 0.38
PRKCA P17252 1/20 0.38
APEX1 P27695 1/20 0.38
RECQL P46063 1/20 0.38
KMT2A Q03164 1/20 0.38
CA1 P00915 2/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
HTT P42858 2/20 0.34
ALOX12 P18054 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL158900 0.81 CA2 (0.46) CA2ALDH1A1TDP1MAPTCA1
SCHEMBL10893525 0.81 CA2 (0.46) CA2ALDH1A1TDP1MEN1MAPT
SCHEMBL30697134 0.81 CA2 (0.46) CA2ALDH1A1TDP1MEN1MAPT
SCHEMBL3636222 0.79 CA2 (0.45) CA2ALDH1A1TDP1MEN1MAPT
SCHEMBL430925 0.79 CA2 (0.45) CA2ALDH1A1TDP1MEN1MAPT
SCHEMBL29539350 0.79 CA2 (0.45) CA2ALDH1A1TDP1MEN1MAPT
SCHEMBL18177313 0.79 ALDH1A1 (0.46) CA2ALDH1A1PRKCEMYLKTDP1
SCHEMBL3706484 0.79 ALDH1A1 (0.46) CA2ALDH1A1PRKCEMYLKTDP1
SCHEMBL30676913 0.78 CA2 (0.43) CA2ALDH1A1TDP1MAPTCA1
SCHEMBL30676815 0.78 CA2 (0.43) CA2ALDH1A1TDP1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2662351-B1 Alkylated heterocyclic reaction products useful as antioxidants SI GROUP INC (US) 2016-03-30 EP disclosed
CN-101528668-A Macromolecular amine-phenolic antioxidant compositions, process technology thereof, and uses thereof ALBEMARLE CORP (US) 2009-09-09 CN disclosed
US-20070027252-A1 Process for improving color of polycondensates CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-02-01 US disclosed
US-20040152807-A1 Stabilizer combination for the rotomolding process STADLER URS LEO (US) 2004-08-05 US disclosed