SCHEMBL8987928

SCHEMBL8987928

CCCCCc1ccc(CC(=O)Nc2ccnc(CC)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.54
ALDH1A1 P00352 4/20 0.47
RIOK2 Q9BVS4 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
CCNE1 P24864 1/20 0.44
CDK2 P24941 1/20 0.44
CDK5 Q00535 1/20 0.44
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPK10 P53779 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL8987842 0.87 SMN1; SMN2 (0.56) ALDH1A1RIOK2LMNARAB9ASMN1; SMN2
SCHEMBL10082521 0.82 NPC1 (0.53) ALDH1A1LMNARAB9ASMN1; SMN2NPC1
SCHEMBL8987776 0.81 CACNA1H (0.48) RIOK2MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL8987914 0.81 CACNA1H (0.48) RIOK2KMT2ARAB9ASMN1; SMN2NPC1
SCHEMBL8987764 0.79 RIOK2 (0.51) ALDH1A1RIOK2MEN1KMT2ACDK5
SCHEMBL8987884 0.78 RIOK2 (0.72) RIOK2MEN1KMT2ACCNE1CDK2
SCHEMBL8987866 0.78 ALDH1A1 (0.46) ALDH1A1RIOK2MEN1KMT2ARAB9A
SCHEMBL8987834 0.78 KMT2A (0.51) ALDH1A1RIOK2MEN1KMT2ARAB9A
SCHEMBL8987643 0.77 MAPK10 (0.46) ALDH1A1RIOK2MEN1KMT2ALMNA
SCHEMBL8987760 0.77 LTA4H (0.44) ALDH1A1MEN1KMT2ARAB9ASMN1; SMN2

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