SCHEMBL29628588

SCHEMBL29628588

O=S(=O)(Cl)c1cccc(Cl)c1-c1ccno1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.39
GAA P10253 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
NFE2L2 Q16236 6/20 0.35
TRPV4 Q9HBA0 1/20 0.35
EDNRA P25101 4/20 0.34
EDNRB P24530 3/20 0.33
EPHX2 P34913 1/20 0.33
SLC40A1 Q9NP59 1/20 0.33
AKR1B1 P15121 1/20 0.33

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
SCHEMBL7843687 0.81 NOTUM (0.50) NOTUMGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL10547439 0.76 ACLY (0.46) NOTUMGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL30027448 0.74 MAPT (0.37) NOTUMGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL31438294 0.74 NOTUM (0.33) NOTUMGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL19682725 0.69 EPHX2 (0.58) NOTUMGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL532898 0.66 PTGES2 (0.50) ALDH1A1MAPTTRPV4SLC40A1
SCHEMBL30731549 0.66 PTGES2 (0.50) ALDH1A1MAPTTRPV4SLC40A1
SCHEMBL14907511 0.66 NOTUM (0.60) NOTUMGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL9189008 0.66 GAA (0.49) NOTUMGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL29628489 0.66 NOTUM (0.55) NOTUM

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
CN-109563057-B Sulfonamide compound or salt thereof 大鹏药品工业株式会社 2022-06-24 CN disclosed