SCHEMBL7895153

SCHEMBL7895153

CCN(C(C)=O)c1c[nH]c2c(Cl)c(Cl)ccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 3/20 0.50
CSNK2B P67870 3/20 0.50
CSNK2A1 P68400 3/20 0.50
LMNA P02545 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
IDO1 P14902 1/20 0.35
ADORA2A P29274 1/20 0.35
ADORA2B P29275 1/20 0.35
ADORA1 P30542 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.34
TNF P01375 2/20 0.34
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.33
PARP14 Q460N5 1/20 0.33
NR4A2 P43354 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL7890296 0.75 LMNA (0.50) LMNANPSR1CYP3A4ALDH1A1HTT
SCHEMBL27474102 0.71 LMNA (0.58) LMNANPSR1ALDH1A1HTTNR4A2
SCHEMBL8041152 0.67 TP53 (0.50) LMNANPSR1ADORA2AADORA2BADORA1
SCHEMBL31061407 0.67 CSNK2A2 (1.00) CSNK2A2CSNK2BCSNK2A1ALDH1A1KDM4E
SCHEMBL17502115 0.67 CSNK2A2 (1.00) CSNK2A2CSNK2BCSNK2A1ALDH1A1KDM4E
SCHEMBL6512784 0.66 CSNK2A2 (0.56) CSNK2A2CSNK2BCSNK2A1LMNANPSR1
SCHEMBL7895151 0.66 CSNK2A1 (0.46) CSNK2A2CSNK2BCSNK2A1LMNAIDO1
SCHEMBL2805448 0.66 CLEC4M (0.67) CSNK2A2CSNK2BCSNK2A1TP53CYP3A4
SCHEMBL2805202 0.65 CSNK2A2 (0.54) CSNK2A2CSNK2BCSNK2A1LMNAIDO1
SCHEMBL9419140 0.64 LMNA (0.44) LMNANPSR1TP53CYP3A4ALDH1A1

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-6180657-B1 SLEEP DISORDERS ELI LILLY AND COMPANY 2001-01-30 US disclosed
WO-1997000069-A1 MELATONIN AGONISTS FOR TREATING BENIGN PROSTATIC HYPERPLASIA ELI LILLY AND COMPANY (US) 1997-01-03 WO disclosed