SCHEMBL8749751

SCHEMBL8749751

Cc1ccccc1-c1cc(O)c(C(C)(C)C)cc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 7/20 0.56
ALDH1A1 P00352 7/20 0.56
SMN1; SMN2 Q16637 5/20 0.56
MAPT P10636 5/20 0.56
CYP1A2 P05177 4/20 0.56
KDM4E B2RXH2 3/20 0.56
ATP2A2 P16615 1/20 0.56
ATP2A3 Q93084 1/20 0.56
CYP3A4 P08684 4/20 0.46
TP53 P04637 4/20 0.46
TSHR P16473 3/20 0.46
TDP1 Q9NUW8 2/20 0.46
MAPK1 P28482 2/20 0.46
HIF1A Q16665 2/20 0.46
GABRA1 P14867 1/20 0.46
GABRB2 P47870 1/20 0.46
CYP2C9 P11712 5/20 0.43
HPGD P15428 5/20 0.43
CYP2C19 P33261 4/20 0.43
HSD17B10 Q99714 3/20 0.43

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
SCHEMBL27549684 0.79 MCL1 (0.55) ALOX15ALDH1A1SMN1; SMN2MAPTCYP1A2
SCHEMBL7761038 0.77 BACE1 (0.64) ALOX15ALDH1A1SMN1; SMN2MAPTCYP1A2
SCHEMBL12293443 0.76 HPGD (0.52) ALOX15ALDH1A1SMN1; SMN2MAPTCYP1A2
SCHEMBL9176175 0.76 ALDH1A1 (0.48) ALOX15ALDH1A1SMN1; SMN2MAPTCYP1A2
SCHEMBL20034068 0.76 GABRA1 (0.50) ALDH1A1SMN1; SMN2CYP1A2CYP3A4TSHR
SCHEMBL2911757 0.76 GABRA1 (0.68) ALDH1A1SMN1; SMN2CYP1A2TSHRTDP1
SCHEMBL38604 0.74 ALOX15 (1.00) ALOX15ALDH1A1SMN1; SMN2MAPTCYP1A2
SCHEMBL11427045 0.74 CA2 (0.57) ALOX15ALDH1A1SMN1; SMN2MAPTCYP1A2
SCHEMBL8976079 0.74 HPGD (0.58) ALOX15ALDH1A1SMN1; SMN2MAPTCYP1A2
SCHEMBL7996981 0.74 ALOX15 (0.68) ALOX15ALDH1A1SMN1; SMN2MAPTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0523470-B1 Complexed hydroquinones POLAROID CORP (US) 1997-03-19 EP claimed
US-5338644-A Form complexes with N,N,N*,N*-tetrasubstituted diamides of aromatic dicarboxylic acids to prevent migration of hydroquinones puring storage POLAROID CORPORATION (US) 1994-08-16 US claimed
EP-0523470-A2 Complexed hydroquinones POLAROID CORPORATION (US) 1993-01-20 EP claimed
EP-0523470-B1 Complexed hydroquinones POLAROID CORP (US) 1997-03-19 EP disclosed
US-5338644-A Form complexes with N,N,N*,N*-tetrasubstituted diamides of aromatic dicarboxylic acids to prevent migration of hydroquinones puring storage POLAROID CORPORATION (US) 1994-08-16 US disclosed
EP-0523470-A2 Complexed hydroquinones POLAROID CORPORATION (US) 1993-01-20 EP disclosed