SCHEMBL1345288

SCHEMBL1345288

CC(c1cc(C(C)(C)C)ccc1O)c1cc(C(C)(C)C)cc(C(C)c2cc(C(C)(C)C)cc(C(C)c3cc(C(C)(C)C)cc(C(C)c4cc(C(C)(C)C)ccc4O)c3O)c2O)c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
ALOX15 P16050 2/20 0.52
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
RORC P51449 1/20 0.49
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
GAA P10253 2/20 0.47
PKM P14618 2/20 0.47
KMT2A Q03164 2/20 0.47
RECQL P46063 1/20 0.47
CYP2D6 P10635 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
GABRA1 P14867 1/20 0.38

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
SCHEMBL1345377 1.00 ALDH1A1 (0.52) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL1345551 1.00 ALDH1A1 (0.52) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL1344654 1.00 ALDH1A1 (0.52) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL51256 0.93 ALDH1A1 (0.59) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL13788012 0.83 ALDH1A1 (0.48) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL5166157 0.81 ALDH1A1 (0.59) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL1344696 0.80 RORC (0.51) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL1345533 0.80 RORC (0.51) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL1344878 0.80 RORC (0.51) ALDH1A1ALOX15HPGDHSD17B10TDP1
SCHEMBL1345305 0.80 RORC (0.51) ALDH1A1ALOX15HPGDHSD17B10TDP1

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-1724119-B1 DEVELOPER MIXTURE FOR THERMAL RECORDING MATERIALS AND THERMAL RECORDING MATERIALS MITSUBISHI CHEM CORP (JP) 2014-11-19 EP disclosed
US-8062993-B2 Developer mixture for thermal recording materials and thermal recording materials API CORPORATION (JP) 2011-11-22 US disclosed
US-20070173407-A1 Developer mixture for thermal recording materials and thermal recording materials API CORPORATION (JP) 2007-07-26 US disclosed
EP-1724119-A1 DEVELOPER MIXTURE FOR THERMAL RECORDING MATERIALS AND THERMAL RECORDING MATERIALS API Corporation (JP) 2006-11-22 EP disclosed