SCHEMBL21597575

SCHEMBL21597575

CC1CN(S(C)(=O)=O)CC1N

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.32
PAX8 Q06710 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CHRNA7 P36544 1/20 0.30

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
SCHEMBL22339776 0.84 CA1 (0.33) CHRNA7
SCHEMBL16472376 0.83 ACHE (0.39) ACHEPAX8KDM4EALDH1A1
SCHEMBL16478638 0.83 ACHE (0.39) ACHEPAX8KDM4EALDH1A1
SCHEMBL24634254 0.83 ACHE (0.39) ACHEPAX8KDM4EALDH1A1
SCHEMBL28880244 0.81 TP53 (0.38) ACHEKDM4EALDH1A1CHRNA7
SCHEMBL23209176 0.81 TP53 (0.38) ACHEKDM4EALDH1A1CHRNA7
SCHEMBL2377043 0.81 TP53 (0.38) ACHEKDM4EALDH1A1CHRNA7
Hydrochloric Acid SCHEMBL25385046 0.79 TP53 (0.37) ACHEKDM4EALDH1A1CHRNA7
SCHEMBL22339772 0.77
SCHEMBL31756276 0.76 TDO2 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3810606-A1 THIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS CAUSED BY IGE UCB Biopharma SRL (BE) 2021-04-28 EP disclosed
CN-112566910-A Thiophene derivatives for the treatment of IgE induced diseases UCB生物制药有限责任公司 2021-03-26 CN disclosed
WO-2019243550-A1 THIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS CAUSED BY IGE UCB Biopharma SRL (BE) 2019-12-26 WO disclosed