SCHEMBL8303645

SCHEMBL8303645

CCCCS(=O)(=O)CCCNC1Cc2ccc(-c3ccc(=O)n(CCCn4ccnc4)n3)cc2C1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.33
HSD17B10 Q99714 2/20 0.33
MEN1 O00255 2/20 0.33
POLB P06746 1/20 0.33
USP2 O75604 1/20 0.32
ALDH1A1 P00352 4/20 0.32
PDE4A P27815 2/20 0.32
PDE4B Q07343 2/20 0.32
PDE4C Q08493 2/20 0.32
PDE4D Q08499 2/20 0.32
KDM4E B2RXH2 3/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 1/20 0.32
NPC1 O15118 1/20 0.32
MAPK1 P28482 1/20 0.32
CYP19A1 P11511 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
CYP2D6 P10635 1/20 0.31
L3MBTL1 Q9Y468 1/20 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
SCHEMBL8305943 0.88 HDAC8 (0.37) KMT2AHSD17B10MEN1POLBPDE4A
SCHEMBL8302569 0.73 MAPT (0.42) KMT2AMEN1PDE4APDE4BPDE4C
SCHEMBL8303647 0.69 HDAC8 (0.45) KMT2AHSD17B10MEN1USP2ALDH1A1
SCHEMBL9414691 0.69 HDAC8 (0.38) KMT2AHSD17B10MEN1POLBALDH1A1
SCHEMBL8304894 0.69 HDAC8 (0.40)
Hydrochloric Acid SCHEMBL8718128 0.68 HDAC8 (0.37) KMT2AHSD17B10MEN1POLBALDH1A1
SCHEMBL8715200 0.68 PDE4A (0.48) KMT2AMEN1POLBPDE4APDE4B
SCHEMBL8302610 0.68 LMNA (0.46) ALDH1A1PDE4APDE4BPDE4CPDE4D
SCHEMBL9414967 0.67 HDAC8 (0.45) KMT2AHSD17B10MEN1POLBUSP2
Hydrochloric Acid SCHEMBL8719903 0.67 HDAC8 (0.45) KMT2AHSD17B10MEN1POLBUSP2

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