SCHEMBL8024467

SCHEMBL8024467

C1=NO1.CCOC(=O)Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.64
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
HTT P42858 2/20 0.53
MAPT P10636 4/20 0.51
RAB9A P51151 3/20 0.49
GAA P10253 1/20 0.49
KCNJ1 P48048 1/20 0.48
KCNH2 Q12809 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46

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
SCHEMBL398701 0.91 LMNA (0.73) LMNAMEN1KMT2AHTTMAPT
SCHEMBL1984377 0.90 LMNA (0.71) LMNAMEN1KMT2AHTTMAPT
SCHEMBL9314768 0.86 LMNA (0.67) LMNAMEN1KMT2AHTTMAPT
SCHEMBL19332232 0.81 LMNA (0.61) LMNAMEN1KMT2AHTTMAPT
SCHEMBL7524136 0.81 MAOB (0.64) LMNAMEN1KMT2AHTTMAPT
SCHEMBL19346040 0.80 LMNA (0.60) LMNAMEN1KMT2AHTTMAPT
SCHEMBL19332234 0.80 LMNA (0.60) LMNAMEN1KMT2AHTTMAPT
SCHEMBL3176303 0.80 LMNA (0.63) LMNAMEN1KMT2AHTTMAPT
SCHEMBL8927983 0.79 CYP2C19 (0.54) MEN1KMT2AHTTMAPTGAA
SCHEMBL8018553 0.79 ALDH1A1 (0.56) LMNAKMT2ARAB9ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0675133-B1 13-Substituted milbemycin derivatives, their preparation and use SANKYO CO (JP) 2000-01-12 EP disclosed
US-5614470-A AGRICULTURAL ANTHELMINTIC, ACARICIDE, INSECTICIDE SANKYO COMPANY, LIMITED (JP) 1997-03-25 US disclosed
EP-0675133-A1 13-Substituted milbemycin derivatives, their preparation and use SANKYO COMPANY LIMITED (JP) 1995-10-04 EP disclosed