SCHEMBL6154621

SCHEMBL6154621

COc1cc(N2C(=O)c3ccccc3C2=O)c(C)cc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.51
▸ ALDH1A1 P00352 5/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ MAPK1 P28482 1/20 0.48
▸ RAB9A P51151 1/20 0.47
▸ RECQL P46063 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ AGTR1 P30556 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.45
▸ NR1H3 Q13133 3/20 0.45
▸ KMT2A Q03164 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ CASP6 P55212 1/20 0.44
▸ TLR9 Q9NR96 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ SCN2A Q99250 1/20 0.43
▸ NR1H2 P55055 2/20 0.43
▸ MASP2 O00187 1/20 0.43

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
SCHEMBL14016799 0.90 ALDH1A1 (0.48) LMNAALDH1A1SMN1; SMN2MAPK1RAB9A
SCHEMBL14016781 0.87 ALDH1A1 (0.48) LMNAALDH1A1SMN1; SMN2MAPK1RAB9A
SCHEMBL14016794 0.85 ALDH1A1 (0.48) LMNAALDH1A1SMN1; SMN2MAPK1RAB9A
SCHEMBL14016785 0.82 MEN1 (0.46) LMNAALDH1A1SMN1; SMN2MAPK1RAB9A
SCHEMBL6156837 0.78 SCN2A (0.57) ALDH1A1NR1H3KMT2AMEN1CASP6
SCHEMBL11304554 0.76 L3MBTL1 (0.74) LMNAALDH1A1SMN1; SMN2MAPK1RECQL
SCHEMBL30758606 0.76 RECQL (0.62) LMNAALDH1A1SMN1; SMN2MAPK1RECQL
SCHEMBL16592564 0.76 RECQL (0.62) LMNAALDH1A1SMN1; SMN2MAPK1RECQL
SCHEMBL6153332 0.75 AR (0.46) ALDH1A1NR1H3KMT2AMEN1CASP6
SCHEMBL18806465 0.73 RECQL (0.62) LMNAALDH1A1RECQLL3MBTL1TDP1

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
US-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 — — US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 LMNA 1200/4885ALDH1A1 2454/4885SMN1; SMN2 3598/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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