SCHEMBL3242390

SCHEMBL3242390

O=C1[C@H]2C/C(=N\O)C[C@H]2C(=O)N1Cc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.59
▸ KMT2A Q03164 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ MAPK1 P28482 2/20 0.51
▸ TSHR P16473 3/20 0.50
▸ CYP2C9 P11712 2/20 0.50
▸ MT-CO2 P00403 2/20 0.50
▸ ALOX5 P09917 2/20 0.50
▸ GAA P10253 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ STAT6 P42226 1/20 0.49
▸ ALOX12 P18054 1/20 0.48
▸ CASP1 P29466 1/20 0.48
▸ CASP7 P55210 1/20 0.48
▸ F2 P00734 1/20 0.46
▸ PLG P00747 1/20 0.46

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
SCHEMBL3242391 1.00 ALDH1A1 (0.59) ALDH1A1KMT2AMEN1MAPK1TSHR
SCHEMBL3236740 0.82 ALDH1A1 (0.69) ALDH1A1KMT2AMEN1MAPK1TSHR
SCHEMBL3884759 0.80 ALDH1A1 (0.67) ALDH1A1KMT2AMEN1MAPK1TSHR
SCHEMBL13783795 0.78 ALDH1A1 (0.73) ALDH1A1KMT2AMEN1MAPK1TSHR
SCHEMBL1023519 0.78 ALDH1A1 (0.73) ALDH1A1KMT2AMEN1MAPK1TSHR
SCHEMBL12372537 0.78 ALDH1A1 (0.73) ALDH1A1KMT2AMEN1MAPK1TSHR
SCHEMBL8147581 0.75 ALDH1A1 (0.69) ALDH1A1KMT2AMEN1MAPK1TSHR
SCHEMBL6747736 0.75 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1MAPK1TSHR
SCHEMBL5770320 0.75 ALDH1A1 (0.69) ALDH1A1KMT2AMEN1MAPK1TSHR
SCHEMBL3716740 0.75 ALDH1A1 (0.93) ALDH1A1KMT2AMEN1MAPK1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7745462-B2 Quinoline-2-one derivatives for the treatment of airways diseases NOVARTIS AG (CH) 2010-06-29 — — US disclosed
US-20070066607-A1 Quinoline-2-one derivatives for the treatment of airways diseases NOVARTIS AG (CH) 2007-03-22 — — US disclosed
EP-1613315-A1 QUINOLINE-2-ONE-DERIVATIVES FOR THE TREATMENT OF AIRWAYS DISEASES Novartis AG (CH) 2006-01-11 — — EP disclosed
WO-2004087142-A1 QUINOLINE-2-ONE-DERIVATIVES FOR THE TREATMENT OF AIRWAYS DISEASES NOVARTIS AG (CH) 2004-10-14 — — WO 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-20070066607-A1 Quinoline-2-one derivatives for the treatment of airways diseases ADRB2, ADRA2C, ADRB1 ALDH1A1 1413/4885KMT2A 1869/4885MEN1 2971/4885

“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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