SCHEMBL11761995

SCHEMBL11761995

NC(/C=C/c1ccccc1[N+](=O)[O-])=NO

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.62
▸ MAOB P27338 1/20 0.57
▸ LMNA P02545 3/20 0.57
▸ MEN1 O00255 5/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ ALDH1A1 P00352 7/20 0.54
▸ RAB9A P51151 3/20 0.54
▸ NPC1 O15118 2/20 0.54
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ NFKB1 P19838 1/20 0.54
▸ NFKB2 Q00653 1/20 0.54
▸ RELA Q04206 1/20 0.54
▸ GAA P10253 1/20 0.54
▸ ATM Q13315 2/20 0.52
▸ HSP90AA1 P07900 1/20 0.52
▸ BACE1 P56817 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ AR P10275 1/20 0.49
▸ CA12 O43570 1/20 0.48

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
SCHEMBL11761990 1.00 MAPT (0.62) MAPTMAOBLMNAMEN1KMT2A
SCHEMBL6153453 0.82 MAPT (0.73) MAPTMAOBLMNAMEN1KMT2A
SCHEMBL114330 0.82 MAPT (0.73) MAPTMAOBLMNAMEN1KMT2A
SCHEMBL5441741 0.79 MAPT (0.63) MAPTMAOBLMNAMEN1KMT2A
SCHEMBL4185541 0.78 MAPT (0.77) MAPTMAOBLMNAMEN1KMT2A
SCHEMBL4185536 0.78 MAPT (0.77) MAPTMAOBLMNAMEN1KMT2A
SCHEMBL9978289 0.77 MAPT (0.69) MAPTMAOBLMNAMEN1KMT2A
SCHEMBL14935499 0.77 MAPT (0.69) MAPTMAOBLMNAMEN1KMT2A
SCHEMBL11049170 0.77 MAPT (0.69) MAPTMAOBLMNAMEN1KMT2A
SCHEMBL820084 0.77 MAPT (1.00) MAPTMAOBLMNAMEN1KMT2A

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-4012377-A ANTIMICROBIAL, PARASITICIDES GLAXO LABORATORIES LIMITED (EN) 1977-03-15 — — US disclosed
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