SCHEMBL5427129

SCHEMBL5427129

Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(N2COCc3ccccc32)CC1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ EPHX2 P34913 1/20 0.49
▸ ALDH1A1 P00352 7/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ HTT P42858 2/20 0.45
▸ MAPT P10636 4/20 0.44
▸ PIK3CA P42336 1/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ CYP3A4 P08684 3/20 0.42
▸ CYP2C19 P33261 3/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CYP2C9 P11712 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL5429985 0.85 HTR6 (0.41) LMNAL3MBTL1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL3148785 0.83 HTR6 (0.59) LMNAL3MBTL1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL5426157 0.78 HTT (0.46) LMNAL3MBTL1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL5428107 0.78 HTR6 (0.47) L3MBTL1ALDH1A1CYP3A4CYP2C19CYP2C9
SCHEMBL5431697 0.78 ALDH1A1 (0.51) LMNAL3MBTL1ALDH1A1SMN1; SMN2HTT
SCHEMBL5436208 0.78 MCOLN3 (0.51) LMNAL3MBTL1EPHX2ALDH1A1MEN1
SCHEMBL5428694 0.77 VCAM1 (0.53) LMNAL3MBTL1ALDH1A1MAPTPIK3CA
SCHEMBL5436127 0.77 LMNA (0.50) LMNAL3MBTL1EPHX2ALDH1A1SMN1; SMN2
SCHEMBL5432653 0.77 TSHR (0.54) LMNAL3MBTL1ALDH1A1SMN1; SMN2HTT
SCHEMBL5423035 0.77 ABL1 (0.45) LMNAL3MBTL1ALDH1A1SMN1; SMN2HTT

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-20070032482-A1 Benzoxazinone-derived sulfonamide compounds, their preparation and use as medicaments LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2007-02-08 — — US claimed
US-20070032482-A1 Benzoxazinone-derived sulfonamide compounds, their preparation and use as medicaments LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2007-02-08 — — US 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-20070032482-A1 Benzoxazinone-derived sulfonamide compounds, their preparation and use as medicaments HTR6, HTR5A, P2RX6 LMNA 3123/4885L3MBTL1 4880/4885EPHX2 2092/4885

“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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