SCHEMBL24765210

SCHEMBL24765210

C[C@H](CN(C)C)NC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CACNA1F O60840 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
ADRA2B P18089 1/20 0.38
CHRM3 P20309 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 1/20 0.38
OPRK1 P41145 1/20 0.38
CACNA1D Q01668 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KCNH2 Q12809 1/20 0.38
CACNA1S Q13698 1/20 0.38
CACNA1C Q13936 1/20 0.38
SCN5A Q14524 1/20 0.38

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
SCHEMBL9860212 1.00 CACNA1F (0.38) CACNA1FCHRM2CHRM1ADRA2BCHRM3
SCHEMBL18711166 0.77 CACNA1F (0.36) CACNA1FCHRM2CHRM1ADRA2BCHRM3
SCHEMBL14554027 0.77
SCHEMBL27696727 0.77
SCHEMBL18963142 0.75
SCHEMBL5933494 0.71 HTR2A (0.31) HRH1
SCHEMBL26322292 0.71 CACNA1F (0.54) CACNA1FCHRM2CHRM1ADRA2BCHRM3
SCHEMBL6782207 0.69
SCHEMBL271024 0.69
SCHEMBL11966005 0.69

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-2022255837-A1 METHOD FOR MANUFACTURING ORGANOMETALLIC COMPOUND AND METHOD FOR FORMING THIN FILM USING SAME 주식회사 한솔케미칼 2022-12-08 WO disclosed