SCHEMBL8307518

SCHEMBL8307518

COC(=O)NC1CCc2ccc(Cl)cc2C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TRPV1 Q8NER1 4/20 0.41
APOB P04114 1/20 0.41
MTTP P55157 1/20 0.41
SLC6A3 Q01959 1/20 0.39
PDE10A Q9Y233 1/20 0.39
F7 P08709 1/20 0.38
PARP1 P09874 1/20 0.38
F3 P13726 1/20 0.38
PARP10 Q53GL7 1/20 0.38
F11 P03951 1/20 0.38
PTGDR Q13258 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.37

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
SCHEMBL12256769 0.85 SMN1; SMN2 (0.53) KDM4ELMNAPOLBMAPTNPC1
SCHEMBL6401395 0.84 CYP19A1 (0.49) KDM4ELMNAPOLBMAPTNPC1
SCHEMBL6401397 0.84 CYP19A1 (0.49) KDM4ELMNAPOLBMAPTNPC1
SCHEMBL29958702 0.78 F7 (0.40) KDM4EMAPTSLC6A3F7PARP1
SCHEMBL27033724 0.78 F7 (0.40) KDM4EMAPTSLC6A3F7PARP1
SCHEMBL9364390 0.77 NPC1 (0.40) KDM4ELMNAPOLBMAPTNPC1
SCHEMBL7272139 0.74 LMNA (0.58) KDM4ELMNAPOLBMAPTRAB9A
SCHEMBL19899052 0.73 F7 (0.43) KDM4EMAPTF7PARP1F3
SCHEMBL8308842 0.73 MTNR1A (0.56) APOBMTTP
SCHEMBL8870631 0.71 LMNA (0.52) KDM4ELMNAPOLBMAPTNPC1

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