SCHEMBL7046812

SCHEMBL7046812

COc1ccc(-c2ccc(Cl)s2)n2nc(N)nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FUBP1 Q96AE4 1/20 0.40
PDGFRB P09619 1/20 0.39
PDGFRA P16234 1/20 0.39
PDE4D Q08499 7/20 0.38
PDE10A Q9Y233 1/20 0.37
NUDT1 P36639 1/20 0.37
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36
TUBB8 Q3ZCM7 1/20 0.36
TUBA3E Q6PEY2 1/20 0.36
TUBA1A Q71U36 1/20 0.36
TUBA1C Q9BQE3 1/20 0.36
TUBB6 Q9BUF5 1/20 0.36
TUBB2B Q9BVA1 1/20 0.36

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
SCHEMBL7146898 0.77 KDM4E (0.51) PDE4DPDE10ATUBB4ATUBBTUBA3C
SCHEMBL7851265 0.76 PDE10A (0.44) PDE4DPDE10ANUDT1TUBB4ATUBB
SCHEMBL7148123 0.75 NUDT1 (0.55) PDE4DPDE10ANUDT1HSP90AB1JAK2
SCHEMBL2250839 0.74 PDE4D (0.64) PDE4DPDE10ANUDT1HSP90AB1JAK2
SCHEMBL7146570 0.73 PDE4D (0.48) PDE4DPDE10ANUDT1TUBB4ATUBB
SCHEMBL7043078 0.73 JAK1 (0.60) PDE4DPDE10AHSP90AB1MAPTALDH1A1
SCHEMBL7144538 0.73 PDE4D (0.49) PDE4DPDE10ATUBB4ATUBBTUBA3C
SCHEMBL7045163 0.73 JAK2 (0.47) PDE4DPDE10ANUDT1HSP90AB1JAK2
SCHEMBL6875680 0.73 PDE10A (0.44) PDGFRBPDGFRAPDE4DPDE10ATUBB4A
SCHEMBL2257907 0.72 MAPT (0.49) PDE4DPDE10AHSP90AB1JAK2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6514989-B1 Has a good affinity to the adenosine receptor and can therefore be used for the treatment or protection of diseases mediated by this receptor HOFFMANN-LA ROCHE INC. 2003-02-04 US claimed
EP-1412352-A1 8-METHOXY-(1,2,4)TRIAZOLO(1,5-A)PYRIDINE DERIVATIVES AND THEIR USE AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2004-04-28 EP disclosed
WO-2003010167-A1 8-METHOXY-(1,2,4)TRIAZOLO(1,5-A)PYRIDINE DERIVATIVES AND THEIR USE AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2003-02-06 WO disclosed
US-6514989-B1 Has a good affinity to the adenosine receptor and can therefore be used for the treatment or protection of diseases mediated by this receptor HOFFMANN-LA ROCHE INC. 2003-02-04 US disclosed