SCHEMBL20565830

SCHEMBL20565830

O=S(=O)(O)NC[C@H]1OC(c2ccccc2)O[C@@H]1c1ccccc1Cl

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HK2 P52789 6/20 0.32
HK1 P19367 5/20 0.32
TBXAS1 P24557 1/20 0.32
TRPM5 Q9NZQ8 1/20 0.32
GCK P35557 1/20 0.32
SLC6A3 Q01959 1/20 0.32
PSMB8 P28062 2/20 0.31
KMT2A Q03164 2/20 0.31
PSMB5 P28074 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
TBXA2R P21731 1/20 0.31
ALDH1A1 P00352 3/20 0.31
KDM4E B2RXH2 2/20 0.31
GLA P06280 2/20 0.31
GAA P10253 2/20 0.31
HPGD P15428 2/20 0.31
CASP1 P29466 2/20 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
SCHEMBL18783320 1.00 HK2 (0.32) HK2HK1TBXAS1TRPM5GCK
SCHEMBL20565964 1.00 HK2 (0.32) HK2HK1TBXAS1TRPM5GCK
SCHEMBL20565682 0.89 HK2 (0.34) HK2HK1GCKPSMB8KMT2A
SCHEMBL18783323 0.89 HK2 (0.34) HK2HK1GCKPSMB8KMT2A
SCHEMBL20566306 0.88 MEN1 (0.36) HK2HK1TBXAS1TRPM5KMT2A
SCHEMBL18783419 0.88 MEN1 (0.36) HK2HK1TBXAS1TRPM5KMT2A
SCHEMBL20565828 0.85 HDAC4 (0.36) KMT2AALDH1A1GAATSHR
SCHEMBL20565688 0.85 HDAC4 (0.36) KMT2AALDH1A1GAATSHR
SCHEMBL20566196 0.85
SCHEMBL20565967 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3079685-B1 SULFAMATE DERIVATIVE COMPOUNDS FOR USE IN TREATING OR ALLEVIATING PAIN BIO PHARM SOLUTIONS CO LTD (KR) 2018-11-28 EP claimed
EP-3079685-B1 SULFAMATE DERIVATIVE COMPOUNDS FOR USE IN TREATING OR ALLEVIATING PAIN BIO PHARM SOLUTIONS CO LTD (KR) 2018-11-28 EP disclosed