SCHEMBL4678908

SCHEMBL4678908

CCn1nc(-c2ccccc2)c(C(C)=O)c(Nc2ccc3ncccc3c2)c1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.67
PABPC1 P11940 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.42
ABCB1 P08183 1/20 0.42
ABCC1 P33527 1/20 0.42
ABCG2 Q9UNQ0 1/20 0.42
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41
TUBA3E Q6PEY2 1/20 0.41
TUBA1A Q71U36 1/20 0.41
TUBA1C Q9BQE3 1/20 0.41
TUBB6 Q9BUF5 1/20 0.41
TUBB2B Q9BVA1 1/20 0.41

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
SCHEMBL3039579 0.93 PDE4B (0.67) PDE4BSMN1; SMN2MEN1KMT2A
SCHEMBL4674784 0.92 PDE4B (0.56) PDE4BPABPC1NPC1MEN1POLB
SCHEMBL4675165 0.90 PDE4B (0.54) PDE4BNPC1MEN1POLBKMT2A
SCHEMBL4674749 0.89 PDE4B (0.52) PDE4BPABPC1ABCB1ABCC1ABCG2
SCHEMBL4706461 0.88 PDE4B (0.74) PDE4BSMN1; SMN2MAPT
SCHEMBL4677346 0.87 PDE4B (0.67) PDE4BSMN1; SMN2NPC1POLBRAB9A
SCHEMBL3032321 0.85 PDE4B (0.64) PDE4BSMN1; SMN2
SCHEMBL4678679 0.85 PDE4B (0.61) PDE4BSMN1; SMN2
SCHEMBL3039908 0.84 PDE4B (0.66) PDE4BSMN1; SMN2MEN1KMT2A
SCHEMBL4675156 0.83 PDE4B (0.59) PDE4BSMN1; SMN2

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