SCHEMBL250063

SCHEMBL250063

CCCCCC1(O)C(=O)Nc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.54
IDO1 P14902 1/20 0.52
TDO2 P48775 1/20 0.52
ATM Q13315 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
ALDH1A1 P00352 3/20 0.51
LMNA P02545 2/20 0.51
HTT P42858 1/20 0.50
MAPT P10636 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
PDK2 Q15119 1/20 0.47
PDK4 Q16654 1/20 0.47
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
HSD17B10 Q99714 1/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
PKM P14618 1/20 0.45
MMP2 P08253 1/20 0.44

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
SCHEMBL10369216 0.95 GAA (0.55) GAAIDO1TDO2ATMSMN1; SMN2
SCHEMBL11883145 0.83 GAA (0.39) GAAIDO1TDO2ATMSMN1; SMN2
SCHEMBL5486391 0.82 MMP2 (0.55) PDK2PDK4MMP2MMP9
SCHEMBL8056975 0.81 GAA (0.61) GAAIDO1TDO2ATMSMN1; SMN2
SCHEMBL25927823 0.81 MMP2 (0.54) PDK2PDK4MMP2MMP9
SCHEMBL28140642 0.80 MMP2 (0.50) PDK2PDK4PKMMMP2MMP9
SCHEMBL31678591 0.80 MMP2 (0.44) GAAIDO1TDO2ALDH1A1MAPT
SCHEMBL17866770 0.80 MMP2 (0.44) GAAIDO1TDO2ALDH1A1MAPT
SCHEMBL17867359 0.80 MMP2 (0.44) GAAIDO1TDO2ALDH1A1MAPT
SCHEMBL8091150 0.79 PDK2 (0.46) GAAALDH1A1LMNAPDK2PDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160106711-A1 3-3-Di-Substituted-Oxindoles as Inhibitors of Translation Initiation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-04-21 US disclosed
WO-2014047437-A1 3-3-DI-SUBSTITUTED-OXINDOLES AS INHIBITORS OF TRANSLATION INITIATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2014-03-27 WO disclosed
US-8354440-B2 3-3-di-substituted-oxindoles as inhibitors of translation initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-01-15 US disclosed
US-8268879-B2 3-3-di-substituted-oxindoles as inhibitors of translation initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-09-18 US disclosed
US-20120077759-A1 3-3-Di-Substituted-Oxindoles as Inhibitors of Translation Initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-03-29 US disclosed
US-8088816-B2 3-3-di-substituted-oxindoles as inhibitors of translation initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-01-03 US disclosed
US-8044089-B2 3-3-di-substituted-oxindoles as inhibitors of translation initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-10-25 US disclosed
US-20110046367-A1 3-3-DI-SUBSTITUTED-OXINDOLES AS INHIBITORS OF TRANSLATION INITIATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2011-02-24 US disclosed
US-7846962-B2 3-3-di-substituted-oxindoles as inhibitors of translation initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-12-07 US disclosed
US-20100256388-A1 3-3-Di-Substituted-Oxindoles As Inhibitors of Translation Initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-10-07 US disclosed
US-20100249201-A1 3-3-Di-Substituted-Oxindoles As Inhibitors of Translation Initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-09-30 US disclosed
US-7737172-B2 3-3-di-substituted-oxindoles as inhibitors of translation initiation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-06-15 US disclosed
US-20090299058-A1 3-3-DI-SUBSTITUTED-OXINDOLES AS INHIBITORS OF TRANSLATION INITIATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-12-03 US disclosed
US-20070099976-A1 3-3-DI-SUBSTITUTED-OXINDOLES AS INHIBITORS OF TRANSLATION INITIATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2007-05-03 US disclosed
EP-1718611-A1 3-3-DI-SUBSTITUTED-OXINDOLES AS INHIBITORS OF TRANSLATION INITIATION The President and Fellows of Harvard College (US) 2006-11-08 EP disclosed
WO-2005080335-A1 3-3-DI-SUBSTITUTED-OXINDOLES AS INHIBITORS OF TRANSLATION INITIATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2005-09-01 WO disclosed
EP-0747354-B1 3-Substituted oxindole derivatives as potassium channel modulators BRISTOL MYERS SQUIBB CO (US) 2000-08-16 EP disclosed
US-5602169-A USEFUL IN REDUCING NEURONAL DAMAGE DURING ISCHEMIC STROKE BRISTOL-MYERS SQUIBB COMPANY (US) 1997-02-11 US disclosed
EP-0747354-A1 3-Substituted oxindole derivatives as potassium channel modulators BRISTOL-MYERS SQUIBB COMPANY (US) 1996-12-11 EP disclosed
US-5565483-A ADMINISTERING AS THERAPY FOR ISCHEMIA, CONVULSIONS OR ASTHMA BRISTOL-MYERS SQUIBB COMPANY (US) 1996-10-15 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 (7 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-20100256388-A1 3-3-Di-Substituted-Oxindoles As Inhibitors of Translation Initiation EIF2AK2, EIF5B, EIF4EBP1 GAA 3345/4885IDO1 501/4885TDO2 1021/4885
US-20090299058-A1 3-3-DI-SUBSTITUTED-OXINDOLES AS INHIBITORS OF TRANSLATION INITIATION EIF2AK2, EIF5B, EIF4EBP1 GAA 3345/4885IDO1 501/4885TDO2 1021/4885
US-20070099976-A1 3-3-DI-SUBSTITUTED-OXINDOLES AS INHIBITORS OF TRANSLATION INITIATION EIF2AK2, EIF5B, EIF4EBP1 GAA 3345/4885IDO1 501/4885TDO2 1021/4885
US-20120077759-A1 3-3-Di-Substituted-Oxindoles as Inhibitors of Translation Initiation EIF2AK2, EIF5B, EIF4EBP1 GAA 3345/4885IDO1 501/4885TDO2 1021/4885
US-20160106711-A1 3-3-Di-Substituted-Oxindoles as Inhibitors of Translation Initiation RIOX2, EIF4A3, RPL35 GAA 3729/4885IDO1 2172/4885TDO2 1181/4885
US-20110046367-A1 3-3-DI-SUBSTITUTED-OXINDOLES AS INHIBITORS OF TRANSLATION INITIATION EIF2AK2, EIF5B, EIF4EBP1 GAA 3345/4885IDO1 501/4885TDO2 1021/4885
US-20100249201-A1 3-3-Di-Substituted-Oxindoles As Inhibitors of Translation Initiation EIF2AK2, EIF5B, EIF4EBP1 GAA 3345/4885IDO1 501/4885TDO2 1021/4885

“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.