SCHEMBL8065124

SCHEMBL8065124

CC(=O)C(C)=Nc1cccc(O)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.42
ALDH1A1 P00352 3/20 0.41
LMNA P02545 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
RECQL P46063 2/20 0.41
HPGD P15428 2/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CDK2 P24941 2/20 0.41
ADAMTS4 O75173 1/20 0.41
EGFR P00533 1/20 0.41
FYN P06241 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
CA6 P23280 1/20 0.41
MMP12 P39900 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ADAMTS5 Q9UNA0 1/20 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
SCHEMBL7091918 0.73 TRPA1 (0.39) ALDH1A1LMNAHPGDHSD17B10TDP1
SCHEMBL7089233 0.72 SIGMAR1 (0.50) ALDH1A1LMNAHPGDALOX15TDP1
SCHEMBL20408303 0.72 SIGMAR1 (0.50) ALDH1A1LMNAHPGDALOX15TDP1
SCHEMBL7089231 0.72 SIGMAR1 (0.50) ALDH1A1LMNAHPGDALOX15TDP1
SCHEMBL7089296 0.72 CYP1A2 (0.50) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL7089301 0.72 CYP1A2 (0.50) ALDH1A1HPGDALOX15HSD17B10TDP1
Pyrogallol SCHEMBL225781 0.71 CA1 (0.71) THRBALDH1A1LMNACA1CA2
SCHEMBL3078969 0.70 LMNA (0.52) ALDH1A1LMNACA1CA2RECQL
SCHEMBL8060455 0.70 MAPT (0.56) THRBALDH1A1LMNACA1CA2
Pyrogallol SCHEMBL8433563 0.69 CA1 (0.67) THRBALDH1A1LMNACA1CA2

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-6015851-A MELT PROCESSABILITY THE GOODYEAR TIRE & RUBBER COMPANY (US) 2000-01-18 US disclosed
EP-0965612-A1 Rubber compositions containig bis anil compounds THE GOODYEAR TIRE & RUBBER COMPANY (US) 1999-12-22 EP disclosed