SCHEMBL8445004

SCHEMBL8445004

CCCC#Cn1nc(-c2ccc(Cl)c(F)c2)ccc1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
KMO O15229 2/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
ABL1 P00519 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
KDM4C Q9H3R0 1/20 0.34
TP53 P04637 1/20 0.34
FFAR1 O14842 1/20 0.34
GRIN2B Q13224 1/20 0.33
KCNH2 Q12809 2/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
PSD A5PKW4 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL5493680 0.83 TSHR (0.46) MAPTMEN1KMT2ATSHR
SCHEMBL5498913 0.79 CA1 (0.37) MAPTMEN1KMT2ACA1CA2
SCHEMBL8300688 0.75 MAPT (0.45) MAPTMEN1KMT2ATP53PDE4A
SCHEMBL9242186 0.70 KMO (0.40) KMOABL1TP53GRIN2B
SCHEMBL8300862 0.70 PTGS1 (0.33) KMOKDM4CFFAR1PTGS1PTGS2
SCHEMBL8299027 0.69 MAPT (0.42) MAPTKMOMEN1KMT2ATP53
SCHEMBL9247381 0.66 FFAR1 (0.40) KMOFFAR1KCNH2PTGS1PTGS2
SCHEMBL9248310 0.64 NPC1 (0.37) KMOKDM4CKCNH2PDE4D
SCHEMBL9243146 0.64 KDM4E (0.39) KMOTP53
SCHEMBL9243119 0.63 L3MBTL1 (0.41) MAPTKMOTP53FFAR1KCNH2

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-5855654-A APPLYING (DIHYDRO)PYRIDAZINONE COMPOUND ROHM AND HAAS COMPANY (US) 1999-01-05 US claimed
EP-0856255-A2 Pyridazinones as marine antifouling agents ROHM AND HAAS COMPANY (US) 1998-08-05 EP disclosed