SCHEMBL8987884

SCHEMBL8987884

CCc1nccc(NC(=O)Cc2ccc3ccccc3c2)n1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIOK2 Q9BVS4 6/20 0.72
GSK3A P49840 3/20 0.67
MAPK10 P53779 3/20 0.67
MAPK8 P45983 1/20 0.67
HIPK1 Q86Z02 1/20 0.67
SNRK Q9NRH2 1/20 0.67
ANO1 Q5XXA6 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
CCNB2 O95067 1/20 0.50
CCNE2 O96020 1/20 0.50
CDK1 P06493 1/20 0.50
CCNB1 P14635 1/20 0.50
CCNA2 P20248 1/20 0.50
CCNE1 P24864 1/20 0.50
CDK2 P24941 1/20 0.50
CCNA1 P78396 1/20 0.50
CDK5 Q00535 1/20 0.50
CDK5R1 Q15078 1/20 0.50

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
SCHEMBL8987764 0.83 RIOK2 (0.51) RIOK2GSK3AMAPK10MAPK8HIPK1
SCHEMBL8987914 0.81 CACNA1H (0.48) RIOK2GSK3AMAPK10MAPK8HIPK1
SCHEMBL8987842 0.80 SMN1; SMN2 (0.56) RIOK2GSK3AMAPK10L3MBTL1HDAC6
SCHEMBL8987776 0.79 CACNA1H (0.48) RIOK2MEN1KMT2ANLRP3
SCHEMBL8987928 0.78 TRPV1 (0.54) RIOK2MAPK10L3MBTL1MEN1KMT2A
SCHEMBL8987871 0.78 ALDH1A1 (0.53) MAPK10MAPK8MEN1KMT2ACCNA2
SCHEMBL8987834 0.78 KMT2A (0.51) RIOK2GSK3AMAPK10MAPK8L3MBTL1
SCHEMBL8987866 0.78 ALDH1A1 (0.46) RIOK2MAPK10ANO1L3MBTL1MEN1
SCHEMBL8987643 0.77 MAPK10 (0.46) RIOK2GSK3AMAPK10MAPK8HIPK1
SCHEMBL8987813 0.77 ALDH1A1 (0.49) RIOK2GSK3AMAPK10MAPK8HIPK1

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-5556859-A N-(4-pyrimidinyl)amide pesticides DOWELANCO (US) 1996-09-17 US disclosed