SCHEMBL9835012

SCHEMBL9835012

NC(=O)N1C(=O)Cc2cc([N+](=O)[O-])ccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
MEN1 O00255 3/20 0.52
GAA P10253 1/20 0.52
SIRT2 Q8IXJ6 2/20 0.49
ALDH1A1 P00352 7/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
POLB P06746 1/20 0.45
APEX1 P27695 1/20 0.45
CASP6 P55212 1/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
LMNA P02545 2/20 0.42
RAB9A P51151 1/20 0.42
TLR9 Q9NR96 1/20 0.42
TDP2 O95551 1/20 0.40
PDE5A O76074 1/20 0.40
BTK Q06187 1/20 0.40
HPGD P15428 1/20 0.39

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
SCHEMBL5624092 0.86 MAPT (0.58) KMT2AMEN1GAASIRT2ALDH1A1
SCHEMBL10173104 0.80 KMT2A (0.47) KMT2AMEN1GAASIRT2ALDH1A1
SCHEMBL662709 0.80 MEN1 (0.49) KMT2AMEN1GAASIRT2ALDH1A1
SCHEMBL16830137 0.79 ALDH1A1 (0.47) KMT2AMEN1GAASIRT2ALDH1A1
SCHEMBL9835222 0.78 KMT2A (0.51) KMT2AMEN1GAAALDH1A1SMN1; SMN2
SCHEMBL10506330 0.77 PDE5A (0.44) KMT2AMEN1GAAALDH1A1SMN1; SMN2
SCHEMBL11006323 0.76 PDE5A (0.43) KMT2AMEN1GAAALDH1A1CASP6
SCHEMBL9833890 0.76 PDE5A (0.65) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL1231915 0.76 GAA (0.57) KMT2AMEN1GAASIRT2ALDH1A1
SCHEMBL7895806 0.76 PDE5A (0.43) KMT2AMEN1ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0208510-B1 1-SUBSTITUTED OXINDOLE-3-CARBOXAMINES AS ANTIINFLAMMATORY AND ANALGESIC AGENTS PFIZER INC. (US) 1991-09-11 EP disclosed
EP-0155828-B1 PROCESS FOR MAKING 2-OXINDOLE-1-CARBOXAMIDES AND INTERMEDIATES THEREFOR PFIZER INC. (US) 1990-09-19 EP disclosed
EP-0156603-B1 3-SUBSTITUTED 2-OXINDOLE-1-CARBOXAMIDES AS ANALGESIC AND ANTI-INFLAMMATORY AGENTS PFIZER INC. (US) 1989-08-23 EP disclosed
US-4791129-A RHEUMATIC DISEASES; ANTIARTHRITIC AGENTS PFIZER INC. (US) 1988-12-13 US disclosed
US-4725616-A ANTIARTHRITIC AGENTS PFIZER INC. (US) 1988-02-16 US disclosed
US-4665194-A ANALGESICS, ANTIINFLAMMATORY AGENTS PFIZER INC. (US) 1987-05-12 US disclosed
US-4652658-A Process for making 2-oxindole-1-carboxamides and intermediates therefor PFIZER INC. (US) 1987-03-24 US disclosed
EP-0208510-A2 1-Substituted oxindole-3-carboxamines as antiinflammatory and analgesic agents PFIZER INC. (US) 1987-01-14 EP disclosed
US-4556672-A 3-Substituted 2-oxindole-1-carboxamides as analgesic and anti-inflammatory agents PFIZER INC. (US) 1985-12-03 US disclosed
EP-0156603-A2 3-Substituted 2-oxindole-1-carboxamides as analgesic and anti-inflammatory agents PFIZER INC. (US) 1985-10-02 EP disclosed
EP-0155828-A2 Process for making 2-oxindole-1-carboxamides and intermediates therefor PFIZER INC. (US) 1985-09-25 EP disclosed