SCHEMBL19478461

SCHEMBL19478461

Cc1ccnc(NC(C)c2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 6/20 0.57
CAMK2D Q13557 3/20 0.56
MAPK14 Q16539 4/20 0.52
NOS2 P35228 1/20 0.51
ADRA1D P25100 1/20 0.50
HTR2C P28335 1/20 0.50
ADRA1A P35348 1/20 0.50
ADRA1B P35368 1/20 0.50
FDPS P14324 1/20 0.50
PLK1 P53350 3/20 0.49
PLK2 Q9NYY3 1/20 0.49
CRHR1 P34998 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
SCHEMBL3555705 0.82 HTR7 (0.59) HTR7CAMK2DMAPK14ADRA1DHTR2C
SCHEMBL17439303 0.82 HTR7 (0.56) HTR7CAMK2DMAPK14ADRA1DHTR2C
SCHEMBL7232240 0.80 AR (0.55) HTR7CAMK2DMAPK14ADRA1DHTR2C
SCHEMBL10594962 0.79 KDM4E (0.56) HTR7FDPS
SCHEMBL17560828 0.79 HTR7 (0.70) HTR7PLK1
SCHEMBL5981398 0.79 KDM4E (0.56) HTR7FDPS
SCHEMBL7242746 0.78 HTR7 (0.52) HTR7CAMK2DMAPK14ADRA1DHTR2C
SCHEMBL29851369 0.78 FDPS (0.59) MAPK14NOS2FDPS
SCHEMBL828257 0.78 FDPS (0.59) MAPK14NOS2FDPS
SCHEMBL828253 0.77 FDPS (0.57) MAPK14NOS2FDPS

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-2970323-B1 FUROPYRIDINES AS BROMODOMAIN INHIBITORS. GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO 2) LTD (GB) 2017-10-18 EP disclosed