SCHEMBL10077573

SCHEMBL10077573

CC(C)(C)OC(=O)NC(CCN1C(=O)C=CC1=O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.58
PPARA Q07869 8/20 0.44
PPARG P37231 7/20 0.44
IDO1 P14902 1/20 0.44
ACE P12821 1/20 0.44
PPARD Q03181 2/20 0.43
ITGA4 P13612 2/20 0.43
ITGB7 P26010 2/20 0.43
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
CTSS P25774 4/20 0.41
CTSK P43235 3/20 0.41
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40

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
SCHEMBL31004971 1.00 AKT1 (0.58) AKT1PPARAPPARGIDO1ACE
SCHEMBL29333170 0.91 AKT1 (0.55) AKT1PPARAPPARGIDO1ACE
SCHEMBL31004972 0.86 AKT1 (0.55) AKT1PPARAPPARGIDO1ACE
SCHEMBL31004975 0.86 AKT1 (0.55) AKT1PPARAPPARGIDO1ACE
SCHEMBL16586992 0.84 AKT1 (0.42) AKT1PPARAPPARGIDO1ACE
SCHEMBL31649054 0.82 AKT1 (0.49) AKT1PPARAPPARGIDO1ACE
SCHEMBL28538006 0.82 AKT1 (0.49) AKT1PPARAPPARGIDO1ACE
SCHEMBL18942140 0.82 AKT1 (0.54) AKT1IDO1ALDH1A1CTSSCTSK
SCHEMBL31004970 0.81 AKT1 (0.48) AKT1ALDH1A1TSHRCTSSCTSK
SCHEMBL18942141 0.81 AKT1 (0.53) AKT1IDO1ITGA4ITGB7ITGB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9340567-B2 Chemistry used in biosensors OHMX CORPORATION (US) 2016-05-17 US disclosed
US-9340567-B2 Chemistry used in biosensors OHMX CORPORATION (US) 2016-05-17 US disclosed
US-20150198552-A9 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2015-07-16 US disclosed
US-20150198552-A9 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2015-07-16 US disclosed
US-8951400-B2 Chemistry used in biosensors OHMX CORPORATION (US) 2015-02-10 US disclosed
US-8951400-B2 Chemistry used in biosensors OHMX CORPORATION (US) 2015-02-10 US disclosed
US-20140311922-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2014-10-23 US disclosed
US-20140311922-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2014-10-23 US disclosed
US-8734631-B2 Chemistry used in biosensors OHMX CORPORATION (US) 2014-05-27 US disclosed
US-8734631-B2 Chemistry used in biosensors OHMX CORPORATION (US) 2014-05-27 US disclosed
WO-2013067349-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2013-05-10 WO disclosed
US-20130112572-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2013-05-09 US disclosed
US-20130112572-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2013-05-09 US disclosed
WO-2012012537-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2012-01-26 WO disclosed
US-20120012472-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2012-01-19 US disclosed
US-20120012472-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2012-01-19 US disclosed
US-20090253149-A1 Novel Chemistry Used in Biosensors OHMX CORPORATION (US) 2009-10-08 US disclosed
US-20090253149-A1 Novel Chemistry Used in Biosensors OHMX CORPORATION (US) 2009-10-08 US disclosed
WO-2009052436-A1 NOVEL CHEMISTRY USED IN BIOSENSORS OHMX CORPORATION (US) 2009-04-23 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 (2 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-20120012472-A1 NOVEL CHEMISTRY USED IN BIOSENSORS SSBP1, OSGEP, OCIAD2 AKT1 4794/4885PPARA 4694/4885PPARG 4575/4885
US-20130112572-A1 NOVEL CHEMISTRY USED IN BIOSENSORS GPX1, GPX4, FECH AKT1 3905/4885PPARA 4600/4885PPARG 4415/4885

“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.