SCHEMBL23729255

SCHEMBL23729255

CNCCCN1CCC2(CC1)CN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.42
TLR8 Q9NR97 1/20 0.40
ACKR3 P25106 3/20 0.39
GPR183 P32249 1/20 0.39
ACACB O00763 1/20 0.39
SCD5 Q86SK9 1/20 0.38
HDAC1 Q13547 1/20 0.37
HDAC2 Q92769 1/20 0.37
CYP11B2 P19099 1/20 0.36
SIGMAR1 Q99720 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
SCHEMBL25028575 0.91 CYP2D6 (0.44) DRD2TLR8ACKR3
SCHEMBL23705617 0.84 ACACB (0.40) DRD2TLR8GPR183ACACBSCD5
SCHEMBL29617085 0.84 ACACB (0.40) DRD2TLR8GPR183ACACBSCD5
SCHEMBL21997274 0.84 ACKR3 (0.50) TLR8ACKR3SIGMAR1
SCHEMBL24373884 0.80 EPHX2 (0.39) GPR183ACACBSCD5HDAC1HDAC2
SCHEMBL17946542 0.79 SCD5 (0.45) GPR183ACACBSCD5HDAC1HDAC2
SCHEMBL28891307 0.79 CYP4F2 (0.41) GPR183ACACBSCD5CYP11B2
SCHEMBL17946237 0.78 ACACB (0.42) GPR183ACACBSCD5HDAC1HDAC2
SCHEMBL23705741 0.78 SIGMAR1 (0.52) DRD2ACKR3SIGMAR1
SCHEMBL996002 0.77 USP2 (0.46) GPR183ACACBSCD5HDAC1HDAC2

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