SCHEMBL23883133

SCHEMBL23883133

CCN(CC)CCCC(C)Nc1c2ccccc2nc2c(O)cccc12

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 11/20 0.77
CCR4 P51679 3/20 0.54

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
SCHEMBL3878308 0.87 CACNA2D1 (1.00) CACNA2D1CCR4
SCHEMBL5471335 0.87 CACNA2D1 (1.00) CACNA2D1CCR4
SCHEMBL23904662 0.85 CACNA2D1 (0.73) CACNA2D1
SCHEMBL14983507 0.79 CACNA2D1 (0.82) CACNA2D1
SCHEMBL5468409 0.79 CACNA2D1 (0.83) CACNA2D1CCR4
SCHEMBL8288054 0.78 CACNA2D1 (0.80) CACNA2D1
SCHEMBL5468037 0.78 CACNA2D1 (0.80) CACNA2D1
SCHEMBL5471094 0.78 CACNA2D1 (0.80) CACNA2D1
SCHEMBL14986075 0.77 USP2 (0.79) CACNA2D1
SCHEMBL5473857 0.76 CACNA2D1 (0.77) CACNA2D1CCR4

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-2021202669-A2 NUCLEOSIDE AND NUCLEOTIDE CONJUGATE COMPOUNDS AND USES THEREOF REYOUNG CORPORATION (US) 2021-10-07 WO disclosed