SCHEMBL31387247

SCHEMBL31387247

CC(C)(C)OC(=O)N1CCc2nocc2C1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.53
NR1H2 P55055 3/20 0.52
MAPT P10636 2/20 0.52
MAPK1 P28482 1/20 0.46
GRAMD1A Q96CP6 1/20 0.42
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NAMPT P43490 3/20 0.41
ADORA1 P30542 1/20 0.41
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
HPGDS O60760 1/20 0.40
PARP1 P09874 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
PARP2 Q9UGN5 1/20 0.40
C5AR1 P21730 1/20 0.38

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
SCHEMBL22727565 0.78 C5AR1 (0.44) ESR2NR1H2MAPTMAPK1GRAMD1A
SCHEMBL2132733 0.78 ESR2 (0.53) ESR2NR1H2MAPTMAPK1GRAMD1A
SCHEMBL31301219 0.77 NAMPT (0.46) MAPTUSP2SMN1; SMN2NAMPT
SCHEMBL16217165 0.77 MAPT (0.54) ESR2NR1H2MAPTMAPK1GRAMD1A
SCHEMBL31409404 0.77 MAPT (0.48) ESR2NR1H2MAPTMAPK1GRAMD1A
SCHEMBL22716642 0.76 C5AR1 (0.43) ESR2NR1H2MAPTMAPK1GRAMD1A
SCHEMBL29640130 0.76 NAMPT (0.46) MAPTNAMPT
SCHEMBL25085668 0.76 ESR2 (0.57) ESR2NR1H2MAPTMAPK1GRAMD1A
SCHEMBL16379671 0.76 MAPT (0.53) ESR2NR1H2MAPTMAPK1GRAMD1A
SCHEMBL1620629 0.76 MAPT (0.58) ESR2NR1H2MAPTMAPK1NAMPT

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-2024255765-A1 NOVEL COMPOUNDS, COMPOSITIONS COMPRISING THE SAME AND USES THEREOF NUPHASE THERAPEUTICS (HANGZHOU) LIMITED., CO. (CN) 2024-12-19 WO disclosed