SCHEMBL5438682

SCHEMBL5438682

CCCCCCCCCCCCc1c(C)ccc(N)c1CCCCCCCCCCCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SKP2 Q13309 1/20 0.47
HTR2A P28223 1/20 0.42
NOS2 P35228 1/20 0.39
TLR8 Q9NR97 4/20 0.39
SRC P12931 1/20 0.39
ESR1 P03372 2/20 0.38
ADRA2A P08913 2/20 0.38
ADORA3 P0DMS8 2/20 0.38
TACR2 P21452 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
KCNH2 Q12809 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
LMNA P02545 1/20 0.38
SHBG P04278 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL5432021 1.00 SKP2 (0.47) SKP2HTR2ANOS2TLR8SRC
SCHEMBL5430925 1.00 SKP2 (0.47) SKP2HTR2ANOS2TLR8SRC
SCHEMBL5428246 1.00 SKP2 (0.47) SKP2HTR2ANOS2TLR8SRC
SCHEMBL5425370 1.00 SKP2 (0.47) SKP2HTR2ANOS2TLR8SRC
SCHEMBL4426814 0.92 SKP2 (0.55) SKP2NOS2TLR8ESR1KDM4E
SCHEMBL9516123 0.92 SKP2 (0.48) SKP2HTR2ATLR8SRCESR1
SCHEMBL294503 0.92 SKP2 (0.48) SKP2HTR2ATLR8SRCESR1
SCHEMBL5567215 0.92 SKP2 (0.48) SKP2HTR2ATLR8SRCESR1
SCHEMBL1498860 0.92 SKP2 (0.48) SKP2HTR2ATLR8SRCESR1
SCHEMBL31521779 0.92 SKP2 (0.48) SKP2HTR2ATLR8SRCESR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070155636-A1 Lubricating oil additive and lubricating oil composition containing the same ADEKA CORPORATION (JP) 2007-07-05 US disclosed
EP-1717298-A1 LUBRICATING OIL ADDITIVE AND LUBRICATING OIL COMPOSITION CONTAINING SAME Adeka Corporation (JP) 2006-11-02 EP disclosed