SCHEMBL2110093

SCHEMBL2110093

CN(C)S(=O)(=O)C1CCC1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ACHE P22303 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 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
SCHEMBL15247510 0.92 ADH1C (0.36) GAAADH1CADH1AKDM4EMEN1
SCHEMBL8100667 0.92 ADH1C (0.36) GAAADH1CADH1AKDM4EMEN1
SCHEMBL3862705 0.88
SCHEMBL717182 0.77 GABRA1 (0.50)
SCHEMBL25249455 0.75 APLNR (0.57) KDM4EKMT2A
Hydrochloric Acid SCHEMBL190753 0.75 GABRA1 (0.48)
SCHEMBL2743254 0.75 HTR2A (0.40) GAAMEN1ALDH1A1KMT2A
SCHEMBL18810339 0.74 RORC (0.33) GAAALDH1A1
SCHEMBL21422755 0.74 RORC (0.33) GAAALDH1A1
SCHEMBL20625197 0.72 TSHR (0.38) MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117940438-A Heterocyclic compounds as MAP4K1 inhibitors 缆图药品公司 2024-04-26 CN disclosed
WO-2023288254-A1 HETEROCYCLIC COMPOUNDS AS MAP4K1 INHIBITORS BLUEPRINT MEDICINES CORPORATION (US) 2023-01-19 WO disclosed
US-8158616-B2 Azetidine and cyclobutane derivatives as JAK inhibitors INCYTE CORPORATION (US) 2012-04-17 US disclosed
WO-2009114512-A1 AZETIDINE AND CYCLOBUTANE DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION (US) 2009-09-17 WO disclosed