SCHEMBL16235767

SCHEMBL16235767

O=C(O)Nc1ccc(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.69
▸ KCNMA1 Q12791 4/20 0.62
▸ L3MBTL1 Q9Y468 2/20 0.60
▸ TRPV1 Q8NER1 1/20 0.58
▸ PKM P14618 1/20 0.56
▸ MEN1 O00255 1/20 0.55
▸ NPC1 O15118 1/20 0.55
▸ RAB9A P51151 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ POLB P06746 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ MAPT P10636 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.54
▸ ALDH1A1 P00352 3/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.51
▸ PHGDH O43175 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL16235764 1.00 APP (0.69) APPKCNMA1L3MBTL1TRPV1PKM
SCHEMBL13379289 0.87 APP (0.66) APPKCNMA1L3MBTL1TRPV1PKM
SCHEMBL26125825 0.87 ALDH1A1 (0.56) APPKCNMA1L3MBTL1PKMMEN1
SCHEMBL3308373 0.86 APP (0.64) APPKCNMA1L3MBTL1TRPV1PKM
SCHEMBL3308366 0.86 APP (0.64) APPKCNMA1L3MBTL1TRPV1PKM
SCHEMBL3308371 0.86 APP (0.64) APPKCNMA1L3MBTL1TRPV1PKM
SCHEMBL10712446 0.85 MAPT (0.64) APPKCNMA1L3MBTL1TRPV1PKM
SCHEMBL20537733 0.84 APP (0.63) APPKCNMA1L3MBTL1TRPV1PKM
SCHEMBL1503974 0.83 APP (0.60) APPKCNMA1L3MBTL1TRPV1PKM
SCHEMBL12035960 0.83 APP (0.60) APPKCNMA1L3MBTL1TRPV1PKM

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
EP-2997028-A1 AZA-OXO-INDOLES FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS INFECTION F.HOFFMANN-LA ROCHE AG (CH) 2016-03-23 — — EP disclosed
WO-2014184163-A1 AZA-OXO-INDOLES FOR THE TREATMENT AND PROPHYLAXIS OF RESPIRATORY SYNCYTIAL VIRUS INFECTION F. HOFFMANN-LA ROCHE AG (CH) 2014-11-20 — — WO disclosed
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