SCHEMBL8997130

SCHEMBL8997130

Cc1cccc(CC(C)CO)c1O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.52
GABRB2 P47870 3/20 0.52
ALDH1A1 P00352 2/20 0.46
TRPA1 O75762 3/20 0.42
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
KDM4E B2RXH2 2/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PTGER1 P34995 1/20 0.35
PTGER4 P35408 1/20 0.35
PTGER3 P43115 1/20 0.35
PTGER2 P43116 1/20 0.35
CYP1A2 P05177 1/20 0.35
SOS2 Q07890 1/20 0.35
PKM P14618 1/20 0.34
HTT P42858 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
SCHEMBL4443328 0.85 GABRA1 (0.52) GABRA1GABRB2ALDH1A1TRPA1CA12
SCHEMBL8997131 0.85 GABRA1 (0.47) GABRA1GABRB2ALDH1A1TRPA1CA12
SCHEMBL29781149 0.83 ESR1 (0.41) GABRA1GABRB2TRPA1KDM4EHSD17B10
SCHEMBL9153697 0.83 GABRA1 (0.59) GABRA1GABRB2TRPA1CA1CA2
SCHEMBL9817577 0.82 TRPA1 (0.42) GABRA1GABRB2ALDH1A1TRPA1KDM4E
SCHEMBL258674 0.82 GABRA1 (0.76) GABRA1GABRB2ALDH1A1TRPA1CA12
SCHEMBL9247390 0.81 GABRA1 (0.55) GABRA1GABRB2ALDH1A1TRPA1CA12
SCHEMBL14895419 0.80 GABRA1 (0.50) GABRA1GABRB2TRPA1CA1CA2
SCHEMBL14478220 0.79 SOS2 (0.54) GABRA1GABRB2ALDH1A1TRPA1SOS2
SCHEMBL8851820 0.78 GABRA1 (0.41) GABRA1GABRB2ALDH1A1TRPA1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0530442-B1 Process for producing a hydroxy-substituted poly (phenylene ether) resin MITSUBISHI CHEM CORP (JP) 1996-09-04 EP claimed
US-5266673-A Compatibilizer for polymer blends and alloys MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1993-11-30 US claimed
EP-0530442-A1 Process for producing a hydroxy-substituted poly (phenylene ether) resin MITSUBISHI CHEMICAL CORPORATION (JP) 1993-03-10 EP claimed
EP-0530442-B1 Process for producing a hydroxy-substituted poly (phenylene ether) resin MITSUBISHI CHEM CORP (JP) 1996-09-04 EP disclosed
US-5266673-A Compatibilizer for polymer blends and alloys MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1993-11-30 US disclosed
EP-0530442-A1 Process for producing a hydroxy-substituted poly (phenylene ether) resin MITSUBISHI CHEMICAL CORPORATION (JP) 1993-03-10 EP disclosed
EP-0517017-A2 Thermoplastic resin composition MITSUBISHI CHEMICAL CORPORATION (JP) 1992-12-09 EP disclosed