SCHEMBL1320952

SCHEMBL1320952

O=C1Nc2cc(Cl)ccc2C1(Br)CC1CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 2/20 0.43
TP53 P04637 8/20 0.41
MDM2 Q00987 8/20 0.41
PKM P14618 1/20 0.38
CMA1 P23946 1/20 0.37
AHR P35869 1/20 0.37
GHSR Q92847 1/20 0.36
TNKS O95271 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRK1 P41145 1/20 0.36
OPRL1 P41146 1/20 0.36
AKR1B1 P15121 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MDM4 O15151 1/20 0.35

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
SCHEMBL30377778 0.81 OPRM1 (0.53) PDE7AMDM2OPRM1OPRK1OPRL1
SCHEMBL7468658 0.76 PDE7A (0.45) PDE7AOPRM1OPRK1OPRL1AKR1B1
SCHEMBL3964443 0.75 MDM2 (0.52) TP53MDM2
SCHEMBL7466189 0.74 IDO1 (0.58) PDE7ATP53OPRM1OPRK1OPRL1
SCHEMBL1320808 0.73 MDM2 (0.43) PDE7ATP53MDM2PKMCMA1
SCHEMBL3967711 0.71 BRD4 (0.47) PDE7ATP53MDM2PKMCMA1
SCHEMBL7465910 0.71 MEN1 (0.43) PDE7AGHSROPRM1OPRK1OPRL1
SCHEMBL1320009 0.70 MDM2 (0.57) TP53MDM2PKM
SCHEMBL5344885 0.70 AHR (0.46) PDE7ATP53MDM2PKMCMA1
SCHEMBL3966441 0.70 BRD4 (0.46) PDE7ATP53MDM2PKMCMA1

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 PDE7A 4827/4885TP53 219/4885MDM2 441/4885

“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.