SCHEMBL31662967

SCHEMBL31662967

Cn1ncc(C(=O)Cl)c1C1CC1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 9/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
SLC9A1 P19634 1/20 0.36
SLC9A2 Q9UBY0 1/20 0.36
HTT P42858 1/20 0.35
HSD11B1 P28845 2/20 0.34
PROKR1 Q8TCW9 1/20 0.34

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
SCHEMBL31663216 0.93 MGLL (0.43) MGLLKEAP1NFE2L2HSD11B1PROKR1
SCHEMBL3678140 0.84 NFE2L2 (0.58) MGLLKEAP1NFE2L2SLC9A1SLC9A2
SCHEMBL21893929 0.78 KEAP1 (0.51) MGLLKEAP1NFE2L2HSD11B1
SCHEMBL16488574 0.77 KEAP1 (0.50) MGLLKEAP1NFE2L2HTTHSD11B1
SCHEMBL28621366 0.77 KEAP1 (0.50) MGLLKEAP1NFE2L2HSD11B1
Potassium Ion SCHEMBL21818514 0.76 MGLL (0.42) MGLLKEAP1NFE2L2HSD11B1PROKR1
SCHEMBL20812233 0.75 MGLL (0.38) MGLLKEAP1NFE2L2
SCHEMBL16488569 0.74 HSD11B1 (0.47) MGLLHSD11B1
SCHEMBL4023990 0.74 HTT (0.35) HTTHSD11B1
SCHEMBL619113 0.74 HTT (0.36) MGLLHTT

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-2025149628-A1 PIPERIDINE DERIVATIVES AS INHIBITORS OF NICOTINAMIDE N-METHYL TRANSFERASE ASTRAZENECA AB (SE) 2025-07-17 WO disclosed