SCHEMBL31332763

SCHEMBL31332763

N#Cc1cccc([C@@]2(CN)CCO2)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ICMT O60725 2/20 0.42
PRKACA P17612 1/20 0.39
PRKACG P22612 1/20 0.39
PRKACB P22694 1/20 0.39
HSD11B1 P28845 1/20 0.39
SLC6A4 P31645 3/20 0.38
SLC6A2 P23975 2/20 0.38
DRD2 P14416 2/20 0.36
DRD3 P35462 2/20 0.36
ADRA2C P18825 1/20 0.35
BACE1 P56817 2/20 0.35
SLC6A3 Q01959 2/20 0.35
KIF11 P52732 1/20 0.34
LOXL2 Q9Y4K0 1/20 0.33
ENPP2 Q13822 1/20 0.33
ADORA2A P29274 1/20 0.33
TRPA1 O75762 1/20 0.33
GSK3B P49841 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
SCHEMBL31332753 1.00 ICMT (0.42) ICMTPRKACAPRKACGPRKACBHSD11B1
SCHEMBL31332690 0.80 SLC6A3 (0.55) ICMTSLC6A4SLC6A2BACE1SLC6A3
SCHEMBL31332704 0.80 SLC6A3 (0.55) ICMTSLC6A4SLC6A2BACE1SLC6A3
SCHEMBL31332698 0.80 SLC6A3 (0.55) ICMTSLC6A4SLC6A2BACE1SLC6A3
SCHEMBL31332738 0.79 HSD11B1 (0.38) ICMTPRKACAPRKACGPRKACBHSD11B1
SCHEMBL4702300 0.75 SLC6A2 (0.38) ICMTPRKACAPRKACGPRKACBHSD11B1
SCHEMBL31332798 0.74 PRKACA (0.45) ICMTPRKACAPRKACGPRKACBHSD11B1
SCHEMBL31332618 0.74 SLC6A3 (0.37) PRKACAPRKACGPRKACBSLC6A4BACE1
SCHEMBL23231697 0.72 HSD11B1 (0.41) HSD11B1SLC6A4SLC6A2BACE1ENPP2
SCHEMBL3508331 0.71 ICMT (0.43) ICMTHSD11B1SLC6A4SLC6A2DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709708-A1 NOVEL CARBOXAMIDE DERIVATIVES ANGELINI PHARMA S.P.A. (IT) 2026-03-18 EP disclosed
WO-2024233603-A1 NOVEL CARBOXAMIDE DERIVATIVES ICAGEN, LLC (US) 2024-11-14 WO disclosed