SCHEMBL27682256

SCHEMBL27682256

CCn1ncc2c(-c3cncc(C)c3)c(CO)c(C3CCCC3)nc21

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.36
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
PRKAA2 P54646 1/20 0.33
PDE5A O76074 1/20 0.33
PDE4B Q07343 2/20 0.33
APLNR P35414 1/20 0.33
MAT2A P31153 8/20 0.33
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE1C Q14123 1/20 0.31
PIK3CA P42336 2/20 0.31
MTOR P42345 2/20 0.31

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
SCHEMBL27662605 0.99 SIGMAR1 (0.37) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL27682188 0.98 SIGMAR1 (0.36) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL27662703 0.96 PRKAA2 (0.36) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL27662625 0.89 PDE5A (0.33) PRKAA2PDE5APDE4BMAT2APIK3CA
SCHEMBL4775049 0.88 PTGS2 (0.37) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL4770021 0.86 PTGS2 (0.37) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL27682217 0.85 PRKAA2 (0.36) PRKAA2PDE5AMAT2APIK3CAMTOR
SCHEMBL27662635 0.85 PRKAA2 (0.36) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL27682255 0.84 MAT2A (0.36) SIGMAR1PSEN1PSEN2APH1BNCSTN
SCHEMBL4779562 0.83 MAT2A (0.36) SIGMAR1PSEN1PSEN2APH1BNCSTN

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
CN-1980927-A Pyrazolopyridine derivatives ASTELLAS PHARMA INC (JP) 2007-06-13 CN disclosed