SCHEMBL10782887

SCHEMBL10782887

O=C(Oc1ccccc1)C1CCCCCCCCCCC1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.76
ELANE P08246 2/20 0.76
KMT2A Q03164 5/20 0.71
HTT P42858 2/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
TDP1 Q9NUW8 1/20 0.71
L3MBTL1 Q9Y468 2/20 0.60
ALDH1A1 P00352 4/20 0.57
RAB9A P51151 2/20 0.57
MAPT P10636 2/20 0.54
MEN1 O00255 1/20 0.54
USP2 O75604 1/20 0.52
ESR1 P03372 1/20 0.51
ESR2 Q92731 1/20 0.51
HPGD P15428 4/20 0.51
KDM4E B2RXH2 2/20 0.51
NPC1 O15118 1/20 0.50
PKM P14618 1/20 0.50
EPHX2 P34913 1/20 0.50
GLA P06280 1/20 0.50

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
SCHEMBL10912890 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; SMN2
SCHEMBL10781602 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; SMN2
SCHEMBL10955343 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; SMN2
SCHEMBL10955716 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; SMN2
SCHEMBL10949493 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; SMN2
SCHEMBL10782854 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; SMN2
SCHEMBL10958586 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; SMN2
SCHEMBL10911289 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; SMN2
SCHEMBL234456 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; SMN2
SCHEMBL10779044 1.00 POLB (0.76) POLBELANEKMT2AHTTSMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0125641-B1 ALKANOYLOXYBENZENESULFONATE SALT PRODUCTION ETHYL CORPORATION (US) 1987-03-04 EP disclosed
US-4588533-A REACTING PHENYL ESTER OF ORGANIC ACID AND SULFUR TRIOXIDE ETHYL CORPORATION (US) 1986-05-13 US disclosed
EP-0165480-A1 Method of preparing acyloxybenzenesulfonic acids and salts thereof ETHYL CORPORATION (US) 1985-12-27 EP disclosed
US-4537724-A Alkanoyloxybenzenesulfonate salt production ETHYL CORPORATION (US) 1985-08-27 US disclosed
EP-0125641-A2 Alkanoyloxybenzenesulfonate salt production ETHYL CORPORATION (US) 1984-11-21 EP disclosed