SCHEMBL13680546

SCHEMBL13680546

Cc1cccc(-c2ccc3c(c2)COC3=O)c1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRF1 P14222 15/20 0.58
PARP10 Q53GL7 1/20 0.55
PARP11 Q9NR21 1/20 0.55
LMNA P02545 2/20 0.53
ALDH1A1 P00352 1/20 0.53
GAA P10253 1/20 0.51
MAPT P10636 1/20 0.51
ACHE P22303 1/20 0.50
FYN P06241 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
DYRK1B Q9Y463 1/20 0.50

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
SCHEMBL16573996 0.87 PRF1 (0.61) PRF1LMNAALDH1A1GAAMAPT
SCHEMBL13469961 0.83 PRF1 (0.65) PRF1LMNAGAAMAPTACHE
SCHEMBL6995518 0.83 LMNA (0.62) PRF1PARP10PARP11LMNAALDH1A1
SCHEMBL14761503 0.78 PRF1 (0.60) PRF1LMNAGAAMAPTACHE
SCHEMBL22643257 0.78 PRF1 (0.55) PRF1LMNAALDH1A1GAAMAPT
SCHEMBL2054407 0.77 PRF1 (0.53) PRF1LMNAALDH1A1GAAMAPT
SCHEMBL19966686 0.77 PRF1 (0.61) PRF1LMNAALDH1A1GAAMAPT
SCHEMBL21508370 0.76 PRF1 (0.56) PRF1LMNAALDH1A1GAAMAPT
SCHEMBL13680566 0.76 PRF1 (0.52) PRF1LMNAALDH1A1GAAMAPT
SCHEMBL1906959 0.75 PARP10 (0.55) PARP10PARP11ALDH1A1GAAMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed
US-7582658-B2 Bicyclic compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-09-01 US disclosed