SCHEMBL6613852

SCHEMBL6613852

Cc1cc(C2CCCC2)nc(N)n1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 16/20 0.61
HRH3 Q9Y5N1 2/20 0.50
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL8817791 0.92 HRH4 (0.50) HRH4HRH3CRHBPCRHR2SMN1; SMN2
SCHEMBL28217398 0.84 HRH4 (0.70) HRH4HRH3
SCHEMBL23036786 0.78 HRH4 (0.43) HRH4HRH3CRHBPCRHR2SMN1; SMN2
SCHEMBL1615966 0.77 HRH4 (0.61) HRH4HRH3
SCHEMBL5750310 0.77 HRH4 (0.61) HRH4HRH3
SCHEMBL12250775 0.76 HRH4 (0.42) HRH4
SCHEMBL28600011 0.76 HRH4 (0.59) HRH4HRH3
SCHEMBL30488040 0.76 HRH4 (0.59) HRH4HRH3
SCHEMBL24309619 0.76 HRH4 (0.59) HRH4HRH3
SCHEMBL8321238 0.76 HRH4 (0.59) HRH4HRH3

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
EP-1377573-A2 PYRAZOLOPYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2004-01-07 EP disclosed
WO-2002048148-A2 PYRAZOLOPYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2002-06-20 WO disclosed