SCHEMBL23933243

SCHEMBL23933243

C[C]1CC(c2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.54
MAPT P10636 1/20 0.54
MAP1LC3B Q9GZQ8 2/20 0.46
BRD4 O60885 3/20 0.45
SLC18A3 Q16572 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
PIM1 P11309 1/20 0.42
FLT3 P36888 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 1/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL4742061 0.76 GAA (0.56) GAAMAPTSLC18A3SIGMAR1PIM1
SCHEMBL31490454 0.76 GAA (0.56) GAAMAPTSLC18A3SIGMAR1PIM1
SCHEMBL9253267 0.75 SLC18A3 (0.52) GAASLC18A3SIGMAR1MEN1KMT2A
Ammonia Solution, Strong SCHEMBL8090454 0.74 GAA (0.54) GAAMAPTSLC18A3SIGMAR1PIM1
SCHEMBL6874305 0.74 MAPT (0.54) GAAMAPTMAP1LC3BBRD4SLC18A3
SCHEMBL449180 0.74 MAPT (0.82) GAAMAPTMAP1LC3BBRD4SLC18A3
SCHEMBL23229609 0.72 GAA (0.42) GAAMAPTMAP1LC3BBRD4SLC18A3
SCHEMBL9746732 0.72 SMN1; SMN2 (0.56) GAAMAPTMAP1LC3BSMN1; SMN2TDP1
SCHEMBL17070910 0.72 MAPT (0.57) GAAMAPTMAP1LC3BBRD4SMN1; SMN2
SCHEMBL41763 0.71

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-2021217040-A1 CARBAMATE AND UREA DERIVATIVES IMMVENTION THERAPEUTIX (US) 2021-10-28 WO claimed