SCHEMBL23729302

SCHEMBL23729302

CC(C)CCOCCCC(=O)N1CCC(CCCCN2CCN(C)CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GNAI3 P08754 4/20 0.46
▸ GNAO1 P09471 4/20 0.46
▸ GNAI1 P63096 4/20 0.46
▸ DRD2 P14416 2/20 0.42
▸ DRD3 P35462 2/20 0.42
▸ ITGB3 P05106 2/20 0.39
▸ ITGA2B P08514 2/20 0.39
▸ PAOX Q6QHF9 1/20 0.37
▸ KDM1A O60341 1/20 0.37
▸ HTR7 P34969 2/20 0.37
▸ NAMPT P43490 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ HSD11B1 P28845 1/20 0.36

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
SCHEMBL26700931 0.91 DRD2 (0.41) GNAI3GNAO1GNAI1DRD2DRD3
SCHEMBL23729306 0.80 HTR7 (0.39) DRD3HTR7NPC1
SCHEMBL23729789 0.79 ALDH1A1 (0.40) GNAI3GNAO1GNAI1NPC1HSD11B1
SCHEMBL23729441 0.78 HTR1A (0.38) DRD2DRD3PAOXHTR7NPC1
SCHEMBL26700936 0.78 HTR1A (0.38) DRD2DRD3PAOXHTR7
SCHEMBL26700934 0.78 HRH2 (0.40) DRD2HTR7
SCHEMBL26700877 0.77 NPC1 (0.38) GNAI3GNAO1GNAI1NPC1
SCHEMBL26700879 0.76 ALDH1A1 (0.37) DRD3HTR7NPC1
SCHEMBL26700958 0.74 HTR7 (0.34) DRD3HTR7NPC1
SCHEMBL26700788 0.74 ALDH1A1 (0.39) NPC1HSD11B1

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-2021155321-A2 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 — — WO disclosed
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