SCHEMBL8693147

SCHEMBL8693147

CCc1ncnc(NC2CCC(c3ccccc3)CC2)c1I

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRCP P42785 1/20 0.41
IRAK4 Q9NWZ3 3/20 0.40
ADORA3 P0DMS8 6/20 0.38
ADORA2A P29274 6/20 0.38
ADORA2B P29275 6/20 0.38
ADORA1 P30542 6/20 0.38
SRC P12931 1/20 0.37
MEN1 O00255 1/20 0.37
CHRM3 P20309 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
GRIN2B Q13224 1/20 0.37
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 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
SCHEMBL8693150 1.00 PRCP (0.41) PRCPIRAK4ADORA3ADORA2AADORA2B
SCHEMBL8596645 0.85 LMNA (0.40) PRCPIRAK4ADORA3ADORA2AADORA2B
SCHEMBL8596643 0.85 LMNA (0.40) PRCPIRAK4ADORA3ADORA2AADORA2B
SCHEMBL8597660 0.85 PRCP (0.41) PRCPIRAK4ADORA3ADORA2AADORA2B
SCHEMBL8490628 0.85 PRCP (0.46) PRCPIRAK4ADORA3ADORA2AADORA2B
SCHEMBL8597662 0.85 PRCP (0.41) PRCPIRAK4ADORA3ADORA2AADORA2B
SCHEMBL8490623 0.85 PRCP (0.46) PRCPIRAK4ADORA3ADORA2AADORA2B
SCHEMBL8595511 0.83 PRCP (0.40) PRCPIRAK4ADORA3ADORA2AADORA2B
SCHEMBL8595512 0.83 PRCP (0.40) PRCPIRAK4ADORA3ADORA2AADORA2B
SCHEMBL8598069 0.82 PRCP (0.39) PRCPIRAK4ADORA3ADORA2AADORA2B

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
US-5852023-A Cyclohexylamino and cycloalkoxy nitrogen heterocycles, processes for their preparation, and their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1998-12-22 US disclosed