SCHEMBL9257428

SCHEMBL9257428

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.49
MAPT P10636 2/20 0.48
HPGD P15428 1/20 0.48
STAT3 P40763 2/20 0.47
ENPP1 P22413 1/20 0.46
PSMD10 O75832 1/20 0.44
ALDH1A1 P00352 5/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
LMNA P02545 2/20 0.43
ALOX12 P18054 1/20 0.43
TP53 P04637 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
HSD17B10 Q99714 1/20 0.42
HTT P42858 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MAPK1 P28482 1/20 0.41
STAT1 P42224 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
SCHEMBL9252362 0.92 PSMD10 (0.50) MAOBMAPTHPGDSTAT3ENPP1
SCHEMBL9253387 0.91 PSMD10 (0.47) MAOBMAPTHPGDSTAT3ENPP1
SCHEMBL6906905 0.88 CA1 (0.50) STAT3ENPP1ALDH1A1KMT2AMEN1
SCHEMBL18289524 0.88 CA1 (0.50) STAT3ENPP1ALDH1A1KMT2AMEN1
SCHEMBL7882874 0.84 CA1 (0.44) STAT3ENPP1ALDH1A1KMT2AMEN1
SCHEMBL4432596 0.84 CA1 (0.49) MAPTSTAT3ENPP1ALDH1A1KMT2A
SCHEMBL22032217 0.81 STAT3 (0.55) STAT3ENPP1PSMD10ALDH1A1KMT2A
SCHEMBL948326 0.81 CNR2 (0.56) MAPTALDH1A1KMT2AMEN1LMNA
SCHEMBL5351657 0.81 CA1 (0.51) MAPTALDH1A1KMT2AMEN1CA1
SCHEMBL21524969 0.81 CA1 (0.48) ALDH1A1KMT2AMEN1CA1CA2

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