SCHEMBL11273574

SCHEMBL11273574

CN1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPN P05981 1/20 0.57
SCN2A Q99250 1/20 0.55
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
MAPT P10636 2/20 0.51
KDM4E B2RXH2 1/20 0.51
ALDH1A1 P00352 2/20 0.51
BCL2A1 Q16548 1/20 0.50
GAA P10253 1/20 0.48
LMNA P02545 1/20 0.44
TSHR P16473 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL854476 0.82 SIRT6 (0.49) SCN2AMEN1KMT2AMAPTALDH1A1
SCHEMBL11653799 0.82 HPN (0.56) HPNSCN2AMEN1KMT2AMAPT
SCHEMBL10854270 0.79 HPN (0.68) HPNSCN2AMEN1KMT2AMAPT
SCHEMBL11286432 0.77 L3MBTL1 (0.62) MEN1KMT2AMAPTALDH1A1BCL2A1
SCHEMBL10508406 0.77 KMT2A (0.55) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL10426399 0.76 L3MBTL1 (0.54) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL6140131 0.76 HPN (0.64) HPNSCN2AMEN1KMT2AMAPT
SCHEMBL1935538 0.75 HPN (0.59) HPNSCN2AMEN1KMT2AMAPT
SCHEMBL12542066 0.75 GAA (0.47) MEN1KMT2AMAPTALDH1A1GAA
SCHEMBL11276548 0.74 ENPP2 (0.49) MEN1KMT2AALDH1A1GAA

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-4345936-A Imidazoles, compositions and herbicidal method ELI LILLY AND COMPANY (US) 1982-08-24 US disclosed