SCHEMBL8715545

SCHEMBL8715545

COC(=O)CC(C(=O)c1ccc2c(c1)CC(N1C(=O)c3ccccc3C1=O)C2)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.39
PDE4B Q07343 4/20 0.39
PDE4C Q08493 4/20 0.39
PDE4D Q08499 4/20 0.39
TNF P01375 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MITF O75030 2/20 0.39
HIF1A Q16665 1/20 0.39
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPT P10636 2/20 0.37
HTT P42858 2/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
KCNA5 P22460 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL8716090 0.82 KCNA5 (0.40) SMN1; SMN2LMNAALDH1A1MITFHIF1A
SCHEMBL8718165 0.79 LMNA (0.40) SMN1; SMN2LMNAALDH1A1ATMNPSR1
SCHEMBL8718189 0.77 ALDH1A1 (0.39) SMN1; SMN2LMNAALDH1A1ATMNPSR1
SCHEMBL8715420 0.74 HDAC8 (0.52) SMN1; SMN2LMNAMAPTTP53KCNA5
SCHEMBL8718162 0.72 L3MBTL1 (0.38) SMN1; SMN2ALDH1A1ATMNPSR1CYP3A4
SCHEMBL8719002 0.71 L3MBTL1 (0.37) SMN1; SMN2ALDH1A1HIF1AATMNPSR1
SCHEMBL26282473 0.69 NTSR1 (0.52) SMN1; SMN2LMNAALDH1A1MITFHIF1A
SCHEMBL3973868 0.69 HTR2A (0.47) SMN1; SMN2ALDH1A1CYP3A4CYP2C19MAPT
SCHEMBL3977324 0.67 CRBN (0.42) SMN1; SMN2LMNAALDH1A1MAPTL3MBTL1
SCHEMBL31154521 0.67 MEN1 (0.47) SMN1; SMN2LMNAALDH1A1MITFHIF1A

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-5739132-A ENDOTHOXIN SHOCK; NEPHRITIS TANABE SEIYAKU CO., LTD. (JP) 1998-04-14 US disclosed
EP-0579059-A1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1994-01-19 EP disclosed