SCHEMBL11035847

SCHEMBL11035847

O=S(=O)(O)C(c1ccccc1)(c1ccccc1)C(O)CCO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.38
KIF11 P52732 4/20 0.33
ALDH1A1 P00352 3/20 0.33
CYP2D6 P10635 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.32
HSD11B1 P28845 1/20 0.32
TRPA1 O75762 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA5A P35218 1/20 0.32
CA9 Q16790 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2C19 P33261 2/20 0.31
DUT P33316 1/20 0.31
SRC P12931 1/20 0.31

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
SCHEMBL11037907 0.86 CYP2D6 (0.38) PTPN1KIF11ALDH1A1CYP2D6MAPK1
SCHEMBL28693125 0.76 CYP2D6 (0.50) PTPN1KIF11ALDH1A1CYP2D6MAPK1
SCHEMBL8659893 0.74 TRPA1 (0.37) KIF11ALDH1A1CYP2D6MAPK1SMN1; SMN2
SCHEMBL28533356 0.71 KMT2A (0.37) KIF11ALDH1A1CYP2D6MAPK1CYP1A2
SCHEMBL14763921 0.71 TRPA1 (0.35) KIF11ALDH1A1CYP2D6MAPK1SMN1; SMN2
SCHEMBL11758958 0.69 PTPN1 (0.38) PTPN1ALDH1A1CYP2D6MAPK1SMN1; SMN2
Sulfuric Acid SCHEMBL27563652 0.67 RIPK1 (0.48) ALDH1A1SMN1; SMN2TRPA1KMT2ACYP2C19
SCHEMBL1855624 0.67 CYP1A2 (0.46) KIF11MAPK1SMN1; SMN2CYP1A2TSHR
SCHEMBL8660267 0.66 THRB (0.34) KIF11ALDH1A1SMN1; SMN2GAACYP1A2
SCHEMBL3870301 0.65 PTPN1 (0.67) PTPN1ALDH1A1CYP2D6MAPK1SMN1; SMN2

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-0105009-B1 METHOD OF PREPARING FOAMS BY CONDENSING METHYLOLDIHYDROXIDEPHENYL ETHER; THEIR APPLICATION AS AN ISOLATION MATERIAL SADEV - SOCIETE D'APPLICATION ET DE DEVELOPPEMENT DE TECHNIQUES NOUVELLES (FR) 1986-03-26 EP claimed