SCHEMBL7736757

SCHEMBL7736757

CC(c1ccccc1)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
S100A4 P26447 2/20 0.50
PTPRC P08575 1/20 0.50
TNF P01375 1/20 0.47
KDM4E B2RXH2 1/20 0.47
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
ATM Q13315 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
UTS2R Q9UKP6 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL6925259 1.00 LMNA (0.52) LMNAS100A4PTPRCTNFKDM4E
SCHEMBL6925120 1.00 LMNA (0.52) LMNAS100A4PTPRCTNFKDM4E
SCHEMBL31259816 0.84 LMNA (0.55) LMNAS100A4PTPRCTNFKDM4E
SCHEMBL11755401 0.84 LMNA (0.55) LMNAS100A4PTPRCTNFKDM4E
SCHEMBL6693216 0.82 TNF (0.48) LMNAS100A4PTPRCTNFKDM4E
SCHEMBL19359510 0.81 KMT2A (0.50) LMNAS100A4PTPRCTNFKDM4E
SCHEMBL23513454 0.78 TNF (0.50) LMNAS100A4PTPRCTNFKDM4E
SCHEMBL11307307 0.77 TNF (0.49) LMNAS100A4PTPRCTNFKDM4E
SCHEMBL19359440 0.77 TNF (0.49) LMNAS100A4PTPRCTNFKDM4E
SCHEMBL19359528 0.77 TNF (0.52) LMNAS100A4PTPRCTNFKDM4E

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-6429212-B1 AMINOPEPTIDASE N INHIBITOR USED TO TREAT CANCER, TUMORS, AND RETINOPATHY; FEW SIDE EFFECTS; ANGIOGENESIS INHIBITOR ISHIHARA SANGYO KAISHA LTD. (JP) 2002-08-06 US disclosed