SCHEMBL3967490

SCHEMBL3967490

O=C(CN1CCN(C(=O)N2CCC(C3(Cc4cccc(Cl)c4)C(=O)Nc4cc(Cl)ccc43)CC2)CC1)N1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 5/20 0.57
TP53 P04637 4/20 0.57
AKR1C3 P42330 3/20 0.41
MAPT P10636 3/20 0.38
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.38
TSHR P16473 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ADAMTS5 Q9UNA0 2/20 0.37
GHSR Q92847 1/20 0.37
FKBP1A P62942 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ADAMTS4 O75173 1/20 0.36
MMP2 P08253 1/20 0.36
MMP13 P45452 1/20 0.36
ADAMTS1 Q9UHI8 1/20 0.36

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
SCHEMBL3969551 0.92 MDM2 (0.68) MDM2TP53AKR1C3MAPTALDH1A1
SCHEMBL3970693 0.84 MDM2 (0.77) MDM2TP53AKR1C3SMN1; SMN2
SCHEMBL4966721 0.82 MDM2 (0.70) MDM2TP53ALDH1A1MEN1KMT2A
SCHEMBL8248411 0.81 MDM2 (0.67) MDM2TP53ALDH1A1MEN1KMT2A
SCHEMBL3969567 0.81 MDM2 (0.80) MDM2TP53ALDH1A1MEN1KMT2A
SCHEMBL4962890 0.79 MDM2 (0.77) MDM2TP53ALDH1A1MEN1KMT2A
SCHEMBL3964717 0.78 MDM2 (0.68) MDM2TP53ADAMTS5GHSR
SCHEMBL3967494 0.78 MDM2 (0.83) MDM2TP53ALDH1A1ADAMTS5MMP2
SCHEMBL3971396 0.77 MDM2 (0.63) MDM2TP53AKR1C3TSHR
SCHEMBL3964876 0.76 TP53 (0.65) MDM2TP53MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576082-B2 Oxindole derivatives HOFFMAN-LA ROCHE INC. (US) 2009-08-18 US claimed
JP-2008543917-A 2008-12-04 JP claimed
EP-1896412-A2 OXINDOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2008-03-12 EP claimed
WO-2006136606-A2 OXINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2006-12-28 WO claimed
US-20060293319-A1 Oxindole derivatives LUK KIM-CHUN 2006-12-28 US claimed
US-7576082-B2 Oxindole derivatives HOFFMAN-LA ROCHE INC. (US) 2009-08-18 US disclosed
US-7576082-B2 Oxindole derivatives HOFFMAN-LA ROCHE INC. (US) 2009-08-18 US disclosed
US-7576082-B2 Oxindole derivatives HOFFMAN-LA ROCHE INC. (US) 2009-08-18 US disclosed
EP-1896412-A2 OXINDOLE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2008-03-12 EP disclosed
WO-2006136606-A2 OXINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2006-12-28 WO disclosed
WO-2006136606-A2 OXINDOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2006-12-28 WO disclosed
US-20060293319-A1 Oxindole derivatives LUK KIM-CHUN 2006-12-28 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-20060293319-A1 Oxindole derivatives CCNI, OGFR, MKI67 MDM2 759/4885TP53 96/4885AKR1C3 139/4885

“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.