SCHEMBL8302610

SCHEMBL8302610

CCCCS(=O)(=O)CCCNC1Cc2ccc(C3=NNC(=O)CC3)cc2C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
NPY1R P25929 1/20 0.46
NPY2R P49146 1/20 0.46
MAPT P10636 2/20 0.41
PDE3B Q13370 13/20 0.40
PDE3A Q14432 13/20 0.40
PDE4A P27815 6/20 0.40
PDE4B Q07343 6/20 0.40
PDE4C Q08493 6/20 0.40
PDE4D Q08499 6/20 0.40
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
KCNH2 Q12809 1/20 0.35

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
SCHEMBL8303551 0.86 LMNA (0.48) LMNANPY1RNPY2RMAPTPDE3B
SCHEMBL8306283 0.86 LMNA (0.47) LMNANPY1RNPY2RMAPTPDE3B
SCHEMBL8720226 0.84 PDE3B (0.38) LMNANPY1RNPY2RMAPTPDE3B
SCHEMBL8307326 0.82 HDAC8 (0.51) LMNANPY1RNPY2RMAPTPDE3B
SCHEMBL8302599 0.79 PDE3B (0.46) LMNANPY1RNPY2RMAPTPDE3B
SCHEMBL8912495 0.78 LMNA (0.46) LMNANPY1RNPY2RMAPTPDE3B
SCHEMBL8302569 0.78 MAPT (0.42) LMNAMAPTPDE3BPDE3APDE4A
SCHEMBL8298942 0.78 TBXA2R (0.44) LMNANPY1RNPY2RMAPTPDE3B
SCHEMBL8304115 0.78 PDE3B (0.47) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL8911889 0.78 CA12 (0.51) LMNANPY1RNPY2RMAPTPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0579059-B1 Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO (JP) 1999-05-12 EP disclosed
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