SCHEMBL1319791

SCHEMBL1319791

O=C([C@H](Cc1ccccc1)NC1(Cc2cccc(Cl)c2)C(=O)Nc2cc(Cl)ccc21)N1CCN(CCO)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 2/20 0.47
▸ CYP3A4 P08684 4/20 0.45
▸ UGCG Q16739 4/20 0.45
▸ TP53 P04637 1/20 0.42
▸ F11 P03951 6/20 0.42
▸ PLG P00747 2/20 0.38
▸ KLKB1 P03952 1/20 0.38
▸ PROC P04070 1/20 0.38
▸ CYP51A1 Q16850 2/20 0.38
▸ PYGL P06737 1/20 0.38
▸ FAAH O00519 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL8205253 0.91 MDM2 (0.49) MDM2CYP3A4UGCGTP53
SCHEMBL1322509 0.87 CYP51A1 (0.51) MDM2CYP3A4UGCGTP53F11
SCHEMBL1323280 0.85 MDM2 (0.46) MDM2CYP3A4UGCGTP53F11
SCHEMBL1321507 0.84 MDM2 (0.59) MDM2TP53PYGL
SCHEMBL1321510 0.84 MDM2 (0.59) MDM2TP53PYGL
SCHEMBL1319273 0.81 MDM2 (0.52) MDM2CYP3A4TP53F11
SCHEMBL1319275 0.81 MDM2 (0.52) MDM2CYP3A4TP53F11
SCHEMBL1320652 0.80 MDM2 (0.54) MDM2TP53FAAHHTT
SCHEMBL1322368 0.79 MDM2 (0.54) MDM2TP53HTT
SCHEMBL3249183 0.79 MDM2 (0.50) MDM2TP53LMNANPSR1

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
US-8058269-B2 rac-6-chloro-3-(3-chloro-benzyl)-3-(3-isopropoxy-phenylamino)-1,3-dihydro-indol-2-one; murine double minute (MDM2 ) oncogene inhibitor; feedback control loop of p53 mutant cells; inhibit the interaction between p53 and MDM2 proteins HOFFMAN-LA ROCHE INC. (US) 2011-11-15 — — US disclosed
US-8058269-B2 rac-6-chloro-3-(3-chloro-benzyl)-3-(3-isopropoxy-phenylamino)-1,3-dihydro-indol-2-one; murine double minute (MDM2 ) oncogene inhibitor; feedback control loop of p53 mutant cells; inhibit the interaction between p53 and MDM2 proteins HOFFMAN-LA ROCHE INC. (US) 2011-11-15 — — US disclosed
US-8058269-B2 rac-6-chloro-3-(3-chloro-benzyl)-3-(3-isopropoxy-phenylamino)-1,3-dihydro-indol-2-one; murine double minute (MDM2 ) oncogene inhibitor; feedback control loop of p53 mutant cells; inhibit the interaction between p53 and MDM2 proteins HOFFMAN-LA ROCHE INC. (US) 2011-11-15 — — US disclosed
EP-2066318-B1 OXINDOLE DERIVATIVES AS ANTICANCER AGENTS HOFFMANN LA ROCHE (CH) 2010-05-12 — — EP disclosed
EP-2066318-B1 OXINDOLE DERIVATIVES AS ANTICANCER AGENTS HOFFMANN LA ROCHE (CH) 2010-05-12 — — EP disclosed
EP-2066318-A2 OXINDOLE DERIVATIVES AS ANTICANCER AGENTS F. Hoffmann-Roche AG (CH) 2009-06-10 — — EP disclosed
US-20080081810-A1 OXINDOLE DERIVATIVES CHEN LI 2008-04-03 — — US disclosed
US-20080081810-A1 OXINDOLE DERIVATIVES CHEN LI 2008-04-03 — — US disclosed
US-20080081810-A1 OXINDOLE DERIVATIVES CHEN LI 2008-04-03 — — US disclosed
WO-2008034736-A2 OXINDOLE DERIVATIVES AS ANTICANCER AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2008-03-27 — — WO disclosed
WO-2008034736-A2 OXINDOLE DERIVATIVES AS ANTICANCER AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2008-03-27 — — 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-20080081810-A1 OXINDOLE DERIVATIVES CCNY, CCNI, RPS4Y1 MDM2 441/4885CYP3A4 385/4885UGCG 4530/4885

“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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