SCHEMBL9253387

SCHEMBL9253387

CC(=O)c1ccc(CCCCOS(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PSMD10 O75832 1/20 0.47
MAOB P27338 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HPGD P15428 2/20 0.45
MAPT P10636 1/20 0.45
STAT3 P40763 1/20 0.44
ENPP1 P22413 1/20 0.44
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 4/20 0.42
HTT P42858 1/20 0.42
FKBP1A P62942 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
GAA P10253 1/20 0.41
LMNA P02545 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ALOX12 P18054 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL9252362 0.96 PSMD10 (0.50) PSMD10MAOBHSD17B10HPGDMAPT
SCHEMBL9257428 0.91 MAOB (0.49) PSMD10MAOBHSD17B10HPGDMAPT
SCHEMBL22032152 0.88 STAT3 (0.55) PSMD10MAPTSTAT3ENPP1RAB9A
SCHEMBL18934371 0.84 ALDH1A1 (0.47) PSMD10NPC1ALDH1A1FKBP1ALMNA
SCHEMBL2567795 0.84 ALDH1A1 (0.47) PSMD10NPC1ALDH1A1FKBP1ALMNA
SCHEMBL829768 0.84 ALDH1A1 (0.50) PSMD10HSD17B10HPGDSTAT3ALDH1A1
SCHEMBL9664444 0.84 LMNA (0.55) MAPTSTAT3ENPP1ALDH1A1L3MBTL1
SCHEMBL14339870 0.83 CA2 (0.43) PSMD10MAPTENPP1NPC1ALDH1A1
SCHEMBL8498573 0.83 CA2 (0.51) PSMD10ENPP1ALDH1A1HTTLMNA
SCHEMBL22084667 0.83 PSMD10 (0.47) PSMD10MAPTSTAT3ENPP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5385693-A Having rapid response and low phase transition temperature SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-31 US disclosed
EP-0357372-B1 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL CO (JP) 1994-11-17 EP disclosed
US-5264151-A Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-11-23 US disclosed
US-5124070-A High speed response SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-06-23 US disclosed
EP-0357372-A2 Optically active ester derivatives, preparation process thereof, liquid crystal materials and a light switching element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-03-07 EP disclosed