SCHEMBL676622

SCHEMBL676622

N[C@H](Cc1cccc(F)c1)CN1C(=O)c2ccccc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
UBE2N P61088 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SLC1A1 P43005 2/20 0.45
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
CA12 O43570 1/20 0.44
GNRHR P30968 2/20 0.44
DPP4 P27487 2/20 0.44
DPP7 Q9UHL4 2/20 0.44
CASP3 P42574 3/20 0.43
ALDH1A1 P00352 1/20 0.42
ALDH3A1 P30838 1/20 0.42
MAPK1 P28482 1/20 0.40
CA1 P00915 1/20 0.40
FAP Q12884 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
EGFR P00533 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL20912948 1.00 UBE2N (0.47) UBE2NTDP1SLC1A1CA2CA9
SCHEMBL676621 1.00 UBE2N (0.47) UBE2NTDP1SLC1A1CA2CA9
SCHEMBL29559650 1.00 UBE2N (0.47) UBE2NTDP1SLC1A1CA2CA9
Ammonia Solution, Strong SCHEMBL1530005 0.99 UBE2N (0.46) UBE2NTDP1SLC1A1CA2CA9
Trifluoroacetic Acid SCHEMBL10323420 0.91 GNRHR (0.48) UBE2NTDP1SLC1A1GNRHRDPP4
SCHEMBL4583448 0.89 CASP3 (0.46) UBE2NTDP1GNRHRCASP3ALDH1A1
SCHEMBL1530021 0.89 CASP3 (0.46) UBE2NTDP1GNRHRCASP3ALDH1A1
SCHEMBL30890110 0.89 CASP3 (0.46) UBE2NTDP1GNRHRCASP3ALDH1A1
SCHEMBL1530019 0.89 CASP3 (0.46) UBE2NTDP1GNRHRCASP3ALDH1A1
Hydrochloric Acid SCHEMBL1529443 0.87 CASP3 (0.44) UBE2NTDP1GNRHRCASP3ALDH1A1

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160287561-A1 Inhibitors of AKT Activity NOVARTIS AG (CH) 2016-10-06 US disclosed
US-20150152092-A1 INHIBITORS OF Akt ACTIVITY NOVARTIS AG (CH) 2015-06-04 US disclosed
US-8946278-B2 Inhibitors of AkT activity GLAXOSMITHKLINE LLC (US) 2015-02-03 US disclosed
US-8895571-B2 Isoindolinone and pyrrolopyridinone derivatives as Akt inhibitors INCYTE CORPORATION (US) 2014-11-25 US disclosed
EP-2117523-B1 INHIBITORS OF AKT ACTIVITY GLAXOSMITHKLINE LLC (US) 2014-06-25 EP disclosed
US-20130231378-A1 INHIBITORS OF AkT ACTIVITY GLAXOSMITHKLINE LLC (US) 2013-09-05 US disclosed
US-20130096144-A1 ISOINDOLINONE AND PYRROLOPYRIDINONE DERIVATIVES AS AKT INHIBITORS INCYTE CORPORATION (US) 2013-04-18 US disclosed
WO-2013056015-A1 ISOINDOLINONE AND PYRROLOPYRIDINONE DERIVATIVES AS AKT INHIBITORS INCYTE CORPORATION (US) 2013-04-18 WO disclosed
US-8410158-B2 Inhibitors of Akt activity GLAXOSMITHKLINE LLC (US) 2013-04-02 US disclosed
US-8338434-B2 Inhibitors of Akt activity GLAXOSMITHKLINE LLC (US) 2012-12-25 US disclosed
WO-2009158376-A1 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2009-12-30 WO disclosed
WO-2009158372-A1 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2009-12-30 WO disclosed
WO-2009158374-A2 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2009-12-30 WO disclosed
WO-2009158371-A1 INHIBITORS OF AKT ACTIVITY SMITHKLIKE BEECHAM CORPORATION (US) 2009-12-30 WO disclosed
WO-2009158373-A1 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2009-12-30 WO disclosed
EP-2117523-A1 INHIBITORS OF AKT ACTIVITY SmithKline Beecham Corporation (US) 2009-11-18 EP disclosed
US-20090209607-A1 INHIBITORS OF AKT ACTIVITY NOVARTIS AG (CH) 2009-08-20 US disclosed
EP-1968568-A2 INHIBITORS OF Akt ACTIVITY SmithKline Beecham Corporation (US) 2008-09-17 EP disclosed
WO-2008098104-A1 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2008-08-14 WO disclosed
WO-2007076423-A2 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2007-07-05 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 (5 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-20130096144-A1 ISOINDOLINONE AND PYRROLOPYRIDINONE DERIVATIVES AS AKT INHIBITORS MTOR, PDPK1, PIK3CA UBE2N 1357/4885TDP1 657/4885SLC1A1 3019/4885
US-20130231378-A1 INHIBITORS OF AkT ACTIVITY AKT2, AKT1, AKT3 UBE2N 2419/4885TDP1 969/4885SLC1A1 3425/4885
US-20090209607-A1 INHIBITORS OF AKT ACTIVITY AKT2, AKT1, AKT3 UBE2N 2419/4885TDP1 969/4885SLC1A1 3425/4885
US-20160287561-A1 Inhibitors of AKT Activity AKT2, AKT1, AKT3 UBE2N 2419/4885TDP1 969/4885SLC1A1 3425/4885
US-20150152092-A1 INHIBITORS OF Akt ACTIVITY AKT2, AKT1, AKT3 UBE2N 2419/4885TDP1 969/4885SLC1A1 3425/4885

“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.