SCHEMBL23536647

SCHEMBL23536647

CC(C)(C)OC(=O)N1CCN(c2nn(S(=O)(=O)c3ccc(S(C)(=O)=O)cc3)c3cccnc23)CC1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 18/20 0.54
JAK2 O60674 1/20 0.44
JAK3 P52333 1/20 0.44
PTK2 Q05397 1/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL3338109 0.78 MEN1 (0.48) GPR119POLB
SCHEMBL3640078 0.75 GPR119 (0.57) GPR119JAK2JAK3PTK2
SCHEMBL3923864 0.73 GPR119 (0.79) GPR119JAK2JAK3PTK2
SCHEMBL20141102 0.72 POLB (0.54) GPR119POLB
SCHEMBL18282626 0.72 POLB (0.51) GPR119POLB
SCHEMBL20223124 0.71 MAP4K4 (0.58) GPR119POLB
SCHEMBL21360402 0.71 POLB (0.53) GPR119POLB
SCHEMBL8923132 0.71 POLB (0.55) GPR119POLB
SCHEMBL3436722 0.71 POLB (0.57) GPR119POLB
SCHEMBL31046329 0.71 POLB (0.57) GPR119POLB

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
WO-2021127333-A1 TRPML MODULATORS CASMA THERAPEUTICS, INC. (US) 2021-06-24 WO disclosed