SCHEMBL24437745

SCHEMBL24437745

CC(C)CCOCCN(C)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.40
PIK3CD O00329 1/20 0.37
HRH4 Q9H3N8 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
MAPK1 P28482 1/20 0.34
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL17916223 0.81 PIK3CD (0.44) PIK3CDHRH4HRH3KMT2AMEN1
SCHEMBL24437849 0.80 ADH1A (0.43) ACHEHRH4HRH3KMT2AMEN1
SCHEMBL13612632 0.78 ACHE (0.40) ACHEHRH4HRH3
SCHEMBL11932511 0.78 PIK3CD (0.41) PIK3CDHRH4HRH3KMT2AMEN1
SCHEMBL16625957 0.77 PIK3CD (0.47) PIK3CDHRH4HRH3KMT2AMEN1
SCHEMBL24437808 0.77 PIK3CD (0.40) PIK3CDHRH4HRH3KMT2AMEN1
SCHEMBL24437806 0.77 PIK3CD (0.40) PIK3CDHRH4HRH3KMT2AMEN1
SCHEMBL22507526 0.77 PIK3CD (0.40) PIK3CDHRH4HRH3KMT2AMEN1
SCHEMBL11932513 0.76 PIK3CD (0.42) PIK3CDHRH4HRH3KMT2AMEN1
SCHEMBL27045475 0.76 ACHE (0.39) ACHEHRH4HRH3

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-2022101453-A1 COMPOUNDS AND METHODS FOR TREATING A CYTOKINE-MEDIATED DISEASE Conservatoire National des Arts et Métiers (FR) 2022-05-19 WO disclosed