SCHEMBL24894530

SCHEMBL24894530

CCCCCc1cn(CCOCCOCCOCCOCCC(=O)NCCC)nn1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.47
DRD2 P14416 3/20 0.46
GBA1 P04062 6/20 0.45
HRH4 Q9H3N8 2/20 0.42
HRH3 Q9Y5N1 2/20 0.42
HDAC1 Q13547 2/20 0.41
CYP19A1 P11511 3/20 0.40
GGPS1 O95749 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
SCHEMBL25835937 0.89 DRD2 (0.42) EPHX2DRD2GBA1GGPS1
SCHEMBL24894086 0.89 DRD2 (0.47) EPHX2DRD2GBA1HRH4HRH3
SCHEMBL26421435 0.88 FOLH1 (0.42) EPHX2DRD2GBA1
SCHEMBL25978189 0.88 GBA1 (0.48) EPHX2DRD2GBA1HRH4HRH3
SCHEMBL25835931 0.86 GBA1 (0.41) EPHX2DRD2GBA1GGPS1
SCHEMBL22083577 0.86 DRD2 (0.44) EPHX2DRD2GBA1HDAC1
SCHEMBL24894084 0.85 EPHX2 (0.51) EPHX2DRD2GBA1HRH4HRH3
SCHEMBL25978195 0.84 FOLH1 (0.44) DRD2HDAC1
SCHEMBL25978193 0.84 DRD2 (0.43) EPHX2DRD2GBA1HRH4HRH3
SCHEMBL24916753 0.84 EPHX2 (0.53) EPHX2DRD2GBA1HRH4HRH3

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-2023288015-A1 M6PR CELL SURFACE RECEPTOR BINDING COMPOUNDS AND CONJUGATES LYCIA THERAPEUTICS, INC. (US) 2023-01-19 WO disclosed