SCHEMBL27363631

SCHEMBL27363631

CNC1CCC(N2CCN(c3ncc(C)cn3)CC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
GPR119 Q8TDV5 2/20 0.39
KCNH2 Q12809 1/20 0.36
DHFR P00374 1/20 0.35
OGA O60502 1/20 0.35
TRPV6 Q9H1D0 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
PTPN11 Q06124 1/20 0.34
IRAK4 Q9NWZ3 2/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PIK3CA P42336 1/20 0.34
MTOR P42345 1/20 0.34

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
SCHEMBL82021 0.89 GPR119 (0.44) DRD2DRD3GPR119KCNH2DHFR
SCHEMBL12525108 0.84 GPR119 (0.47) GPR119KCNH2PTPN11MAPK1
SCHEMBL82297 0.83 GPR119 (0.41) GPR119KCNH2DHFROGATRPV6
SCHEMBL27363069 0.79 SIGMAR1 (0.33) DRD2DRD3KCNH2TRPV6HRH3
SCHEMBL14853335 0.76 L3MBTL3 (0.50) GPR119KCNH2HRH3ALDH1A1
SCHEMBL24018524 0.75 GPR119 (0.39) GPR119KCNH2DHFROGAALDH1A1
SCHEMBL12793873 0.75 POLB (0.34) DRD2DRD3HRH3MEN1ALDH1A1
SCHEMBL12793878 0.75 POLB (0.34) DRD2DRD3HRH3MEN1ALDH1A1
SCHEMBL15685757 0.75 POLB (0.34) DRD2DRD3HRH3MEN1ALDH1A1
SCHEMBL12490730 0.74 OPRK1 (0.52) GPR119KCNH2

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-2024054591-A1 RAPIDLY ACCELERATED FIBROSARCOMA (RAF) DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2024-03-14 WO disclosed