SCHEMBL7204689

SCHEMBL7204689

Nc1nc(Cl)nc2c1ncn2Cc1ccc(F)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE8A O60658 10/20 0.60
PDE4A P27815 1/20 0.54
PDE4B Q07343 1/20 0.54
PDE4C Q08493 1/20 0.54
PDE4D Q08499 1/20 0.54
HDAC3 O15379 4/20 0.53
HDAC4 P56524 4/20 0.53
HDAC1 Q13547 4/20 0.53
HDAC7 Q8WUI4 4/20 0.53
HDAC2 Q92769 4/20 0.53
HDAC10 Q969S8 4/20 0.53
HDAC11 Q96DB2 4/20 0.53
HDAC8 Q9BY41 4/20 0.53
HDAC6 Q9UBN7 4/20 0.53
HDAC9 Q9UKV0 4/20 0.53
HDAC5 Q9UQL6 4/20 0.53
YTHDC1 Q96MU7 3/20 0.50
CDK1 P06493 1/20 0.50
ADORA2A P29274 1/20 0.48
PI4KA P42356 1/20 0.48

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
SCHEMBL13596787 0.89 PDE8A (0.62) PDE8APDE4APDE4BPDE4CPDE4D
SCHEMBL21977339 0.87 CDK1 (0.57) PDE4APDE4BPDE4CPDE4DHDAC4
SCHEMBL1146681 0.86 YTHDC1 (0.67) PDE8APDE4APDE4BPDE4CPDE4D
SCHEMBL2060472 0.86 PDE4A (0.67) PDE8APDE4APDE4BPDE4CPDE4D
SCHEMBL5461215 0.86 HDAC6 (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL21076723 0.84 PDE8A (0.57) PDE8APDE4APDE4BPDE4CPDE4D
SCHEMBL23764385 0.83 PDE8A (0.59) PDE8APDE4APDE4BPDE4CPDE4D
SCHEMBL822875 0.83 PDE8A (0.56) PDE8APDE4APDE4BPDE4CPDE4D
SCHEMBL2060105 0.82 PDE8A (0.55) PDE8APDE4APDE4BPDE4CPDE4D
SCHEMBL3959823 0.81 PDE8A (0.67) PDE8APDE4APDE4BPDE4CPDE4D

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-1035123-B1 NOVEL HETEROCYCLIC COMPOUNDS SUMITOMO PHARMA (JP) 2003-08-20 EP disclosed
US-6329381-B1 INTERFERONS, VIRICIDES AND ANTICARCINOGENIC AGENTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-12-11 US disclosed
EP-1035123-A1 NOVEL HETEROCYCLIC COMPOUNDS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-09-13 EP disclosed