SCHEMBL4674784

SCHEMBL4674784

CCn1nc(-c2ccc(F)cc2)c(C(C)=O)c(Nc2ccc3ncccc3c2)c1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.56
BRAF P15056 1/20 0.41
MAT2A P31153 1/20 0.39
AHR P35869 1/20 0.39
NPC1 O15118 4/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 2/20 0.39
MAPT P10636 2/20 0.39
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
RAB9A P51151 3/20 0.38
PABPC1 P11940 1/20 0.38
NOTUM Q6P988 1/20 0.38
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 1/20 0.37
CSNK1D P48730 1/20 0.37
CSNK1E P49674 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
SCHEMBL4678908 0.92 PDE4B (0.67) PDE4BMAT2ANPC1MEN1KMT2A
SCHEMBL4678987 0.89 SLC34A1 (0.44) PDE4BMAPK14
SCHEMBL4675165 0.86 PDE4B (0.54) PDE4BBRAFMAT2ANPC1MEN1
SCHEMBL3039579 0.85 PDE4B (0.67) PDE4BMEN1KMT2ANOTUM
SCHEMBL3022173 0.82 PDE4B (0.51) PDE4BAHRMEN1KMT2APOLB
SCHEMBL4674594 0.82 PDE4B (0.54) PDE4BAHRPOLBMAPT
SCHEMBL4707416 0.82 PDE4B (0.80) PDE4BMAPT
SCHEMBL1651191 0.82 PDE4B (0.59) PDE4BPOLBMAPT
SCHEMBL3037371 0.82 PDE4B (0.54) PDE4BAHRMEN1KMT2AMAPT
SCHEMBL3029781 0.81 PDE4B (0.50) PDE4BMEN1KMT2AMAPTCSNK1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1575926-B1 NEW PYRIDAZIN-3(2H)-ONE DERIVATIVES ALMIRALL LAB (ES) 2008-03-05 EP claimed