SCHEMBL11284152

SCHEMBL11284152

CC(C)c1nc(N)c(S)c(N)n1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.36
ADORA1 P30542 1/20 0.36
HRH4 Q9H3N8 1/20 0.33

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
SCHEMBL11802553 0.72 HRH4 (0.34) ADORA2AADORA1HRH4
SCHEMBL15994399 0.71 HRH4 (0.52) ADORA2AADORA1HRH4
SCHEMBL17612192 0.69
SCHEMBL4330004 0.69 HSP90AB1 (0.33) ADORA2AADORA1
SCHEMBL1425789 0.69 HRH4 (0.50) ADORA2AADORA1HRH4
SCHEMBL2611024 0.65 HRH4 (0.34) ADORA2AADORA1HRH4
SCHEMBL10399424 0.65 NOS2 (0.48) ADORA2AADORA1HRH4
SCHEMBL22623613 0.62 NOS2 (0.41) ADORA2AADORA1HRH4
SCHEMBL24296391 0.61 ADORA2A (0.41) ADORA2AHRH4
SCHEMBL6247828 0.60 HRH4 (0.43) ADORA2AADORA1HRH4

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-0065811-A1 Disperse azopyrimidine dyestuffs IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1982-12-01 EP disclosed