SCHEMBL8206478

SCHEMBL8206478

CC(=O)N1CCN(C(=O)N[C@H]2CCCN(C3(Cc4cccc(Cl)c4)C(=O)Nc4cc(Cl)ccc43)C2)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 9/20 0.59
TP53 P04637 5/20 0.59
NPC1 O15118 1/20 0.39
PTGS2 P35354 1/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD11B1 P28845 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
USP30 Q70CQ3 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
SCHEMBL8211049 0.94 MDM2 (0.53) MDM2TP53NPC1PTGS2KMT2A
SCHEMBL8204799 0.92 MDM2 (0.51) MDM2TP53NPC1PTGS2KMT2A
SCHEMBL12121846 0.91 MDM2 (0.50) MDM2TP53NPC1PTGS2KMT2A
SCHEMBL8210751 0.91 MDM2 (0.51) MDM2TP53NPC1PTGS2KMT2A
SCHEMBL8211051 0.90 MDM2 (0.50) MDM2TP53NPC1PTGS2KMT2A
SCHEMBL1321776 0.87 MDM2 (0.61) MDM2TP53KMT2ALMNAMEN1
SCHEMBL1319277 0.83 MDM2 (0.56) MDM2TP53KMT2ALMNAMEN1
SCHEMBL1322958 0.83 MDM2 (0.51) MDM2TP53KMT2AMEN1CNR1
SCHEMBL1321485 0.81 MDM2 (0.56) MDM2TP53KMT2AMEN1ALDH1A1
SCHEMBL3250970 0.81 MDM2 (0.49) MDM2TP53NPC1PTGS2KMT2A

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 6 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
EP-2066318-B1 OXINDOLE DERIVATIVES AS ANTICANCER AGENTS HOFFMANN LA ROCHE (CH) 2010-05-12 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
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 441/4885TP53 219/4885NPC1 4187/4885

“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.