SCHEMBL4793019

SCHEMBL4793019

COCCC(C)Oc1nc(C)nc2c1CCN2c1ccc(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 8/20 0.43
DRD2 P14416 2/20 0.37
HTR2A P28223 2/20 0.37
HTR7 P34969 2/20 0.37
HTR6 P50406 2/20 0.37
GPR119 Q8TDV5 2/20 0.34
HTR1A P08908 1/20 0.34
CNR1 P21554 1/20 0.33
TLR8 Q9NR97 1/20 0.33
HPGD P15428 1/20 0.32

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
SCHEMBL4762104 0.87 CRHR1 (0.43) CRHR1DRD2HTR2AHTR7HTR6
SCHEMBL4767150 0.84 CRHR1 (0.43) CRHR1DRD2HTR2AHTR7HTR6
SCHEMBL4763293 0.83 CRHR1 (0.44) CRHR1DRD2HTR2AHTR7HTR6
SCHEMBL4763245 0.83 CRHR1 (0.46) CRHR1DRD2HTR2AHTR7HTR6
SCHEMBL4763287 0.81 CRHR1 (0.41) CRHR1DRD2HTR2AHTR7HTR6
SCHEMBL4762385 0.79 CRHR1 (0.43) CRHR1DRD2HTR2AHTR7HTR6
SCHEMBL4763067 0.79 CRHR1 (0.43) CRHR1DRD2HTR2AHTR7HTR6
SCHEMBL4767336 0.78 CRHR1 (0.42) CRHR1DRD2HTR2AHTR7HTR6
SCHEMBL6639521 0.78 CRHR1 (0.46) CRHR1HTR7HTR1ACNR1
SCHEMBL13986668 0.77 CRHR1 (0.42) CRHR1DRD2HTR2AHTR7HTR6

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-1395591-B1 CORTICOTROPIN RELEASING FACTOR ANTAGONISTS GLAXO GROUP LTD (GB) 2008-06-04 EP disclosed