SCHEMBL3885343

SCHEMBL3885343

O=C1OC(c2ccccc2)(c2ccccc2)c2c1cccc2S(=O)(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 1/20 0.51
GOPC Q9HD26 1/20 0.51
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43
MEN1 O00255 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.43
ALDH1A1 P00352 2/20 0.43
TYMS P04818 2/20 0.43
ESR1 P03372 1/20 0.43
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ESR2 Q92731 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
GPR55 Q9Y2T6 1/20 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
SCHEMBL4258727 0.75 CFTR (0.59) CFTRGOPCGAAPKMMEN1
SCHEMBL3886398 0.69 CFTR (1.00) CFTRGOPCGAAPKMMEN1
SCHEMBL3885344 0.68 CFTR (0.39) CFTRGOPCGAAPKMMEN1
SCHEMBL458284 0.67 SMN1; SMN2 (0.48) GAAMEN1MAPTKMT2ALMNA
SCHEMBL1026183 0.66 MEN1 (0.63) CFTRGOPCGAAPKMMEN1
Phenolphthalein SCHEMBL2546185 0.66 MAPT (0.88) CFTRGOPCGAAPKMMEN1
Phenolphthalein SCHEMBL7926066 0.66 MAPT (0.88) CFTRGOPCGAAPKMMEN1
SCHEMBL28837581 0.65 SMN1; SMN2 (0.46) GAAMEN1MAPTKMT2ALMNA
SCHEMBL3886837 0.65 MAPT (0.93) CFTRGOPCGAAPKMMEN1
SCHEMBL232659 0.64 CASP1 (0.47) ALDH1A1TSHRSMN1; SMN2HSD17B10PGAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2014735-A2 POLYMER ANISOTROPIC ELECTROCONDUCTIVE GLUING MATERIAL AND A GLUING METHOD Koltsova, Anastasia Adrianovna (RU) 2009-01-14 EP disclosed