SCHEMBL8488227

SCHEMBL8488227

CC1(C2CCC(Nc3ncc4ccccc4n3)CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCNA2 P20248 10/20 0.46
CDK2 P24941 10/20 0.46
CCNK O75909 7/20 0.46
CDK12 Q9NYV4 7/20 0.46
ADRA2A P08913 2/20 0.43
NPY5R Q15761 2/20 0.43
MCHR1 Q99705 2/20 0.43
PDE10A Q9Y233 3/20 0.42
CDK7 P50613 8/20 0.41
CCNH P51946 8/20 0.41
MNAT1 P51948 8/20 0.41
HTR3A P46098 1/20 0.41
ROCK2 O75116 1/20 0.41
ALDH1A1 P00352 1/20 0.40
RIPK2 O43353 1/20 0.40
JUN P05412 1/20 0.40
MAPK10 P53779 1/20 0.40

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
SCHEMBL8488225 1.00 CCNA2 (0.46) CCNA2CDK2CCNKCDK12ADRA2A
SCHEMBL8487669 0.95 CCNA2 (0.43) CCNA2CDK2CCNKCDK12ADRA2A
SCHEMBL8487675 0.95 CCNA2 (0.43) CCNA2CDK2CCNKCDK12ADRA2A
SCHEMBL16666131 0.81 NPY5R (0.50) CCNA2CDK2CCNKCDK12ADRA2A
SCHEMBL558139 0.80 MAPK8 (0.56) CCNA2CDK2CCNKCDK12RIPK2
SCHEMBL558138 0.80 MAPK8 (0.56) CCNA2CDK2CCNKCDK12RIPK2
SCHEMBL558347 0.80 NPY5R (0.52) CCNA2CDK2CCNKCDK12ADRA2A
SCHEMBL28234157 0.80 CCNA2 (0.49) CCNA2CDK2CCNKCDK12ADRA2A
SCHEMBL31108105 0.77 CDK2 (0.56) CCNA2CDK2CCNKCDK12ADRA2A
SCHEMBL23003096 0.77 CCNA2 (0.44) CCNA2CDK2CCNKCDK12ADRA2A

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-5889012-A INSECTICIDE, ACARICIDES, FUNGICIDES HOECHST-SCHERING AGREVO GMBH (DE) 1999-03-30 US disclosed