SCHEMBL1485387

SCHEMBL1485387

CC1(C)CCN[C@@H]1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.44
PITRM1 Q5JRX3 2/20 0.44
DPP9 Q86TI2 2/20 0.44
FAP Q12884 1/20 0.44
DPP8 Q6V1X1 1/20 0.44
DPP7 Q9UHL4 1/20 0.44
ARG1 P05089 2/20 0.37
PKM P14618 1/20 0.32
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL2211371 1.00 DPP4 (0.44) DPP4PITRM1DPP9FAPDPP8
SCHEMBL1023253 1.00 DPP4 (0.44) DPP4PITRM1DPP9FAPDPP8
SCHEMBL23536 0.80 ARG1 (0.49) DPP4PITRM1DPP9FAPDPP8
SCHEMBL23535 0.80 ARG1 (0.49) DPP4PITRM1DPP9FAPDPP8
Hydrochloric Acid SCHEMBL905291 0.78 ARG1 (0.47) DPP4PITRM1DPP9FAPDPP8
Hydrochloric Acid SCHEMBL16393846 0.78 ARG1 (0.47) DPP4PITRM1DPP9FAPDPP8
Hydrochloric Acid SCHEMBL905290 0.78 ARG1 (0.47) DPP4PITRM1DPP9FAPDPP8
SCHEMBL6245228 0.76 DPP4 (0.40) DPP4PITRM1DPP9FAPDPP8
SCHEMBL15790686 0.76 ARG1 (0.33) ARG1
Hydrochloric Acid SCHEMBL15776241 0.74 ARG1 (0.32) ARG1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1913889-A Compositions comprising HIV protease inhibitor and cytochrome P450 enzyme activity inhibitor PFIZER (US) 2007-02-14 CN claimed
US-9670228-B2 Benzoxazepin PI3K inhibitor compounds and methods of use GENENTECH, INC. (US) 2017-06-06 US disclosed
US-20170081341-A1 BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH, INC. (US) 2017-03-23 US disclosed
US-9546178-B2 Benzoxazepin PI3K inhibitor compounds and methods of use GENENTECH, INC. (US) 2017-01-17 US disclosed
US-20160052933-A1 BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2016-02-25 US disclosed
US-9198918-B2 Benzoxazepin PI3K inhibitor compounds and methods of use GENENTECH, INC. (US) 2015-12-01 US disclosed
EP-2845592-A1 Benzoxazepin PI3K inhibitor compounds and methods of use F. Hoffmann-La Roche AG (CH) 2015-03-11 EP disclosed
US-20140288047-A1 BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH INC (US) 2014-09-25 US disclosed
US-8785626-B2 Benzoxazepin PI3K inhibitor compounds and methods of use GENENTECH, INC. (US) 2014-07-22 US disclosed
EP-2711368-A1 Benzoxazepin PI3K inhibitor compounds and methods of use F. Hoffmann-La Roche AG (CH) 2014-03-26 EP disclosed
US-20090239866-A1 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-09-24 US disclosed
EP-1912662-A2 PEPTIDE DEFORMYLASE INHIBITORS SmithKline Beecham Corporation (US) 2008-04-23 EP disclosed
CN-1938017-A Therapeutic combinations AGOURON PHARMA (US) 2007-03-28 CN disclosed
CN-1913889-A Compositions comprising HIV protease inhibitor and cytochrome P450 enzyme activity inhibitor PFIZER (US) 2007-02-14 CN disclosed
WO-2007016364-A2 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-08 WO disclosed
WO-2007016364-A2 PEPTIDE DEFORMYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2007-02-08 WO disclosed
US-4636567-A CNS DISORDERS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1987-01-13 US disclosed
US-4610821-A CENTRAL NERVOUS SYSTEM, THYROTROPIN RELEASING HORMONE YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-09-09 US disclosed
US-4564609-A NERVOUS SYSTEM DISORDERS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-01-14 US disclosed
EP-0123444-A1 4-Substituted-2-azetidinone compound, process of producing the compounds, and medicaments containing the compounds YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1984-10-31 EP 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 (4 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-20140288047-A1 BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE BMX, PIK3CA, PI4KA DPP4 2923/4885PITRM1 2007/4885DPP9 4192/4885
US-20090239866-A1 PEPTIDE DEFORMYLASE INHIBITORS PDF, PEPD, DPEP1 DPP4 46/4885PITRM1 715/4885DPP9 21/4885
US-20160052933-A1 BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE BMX, PIK3CA, PI4KA DPP4 2923/4885PITRM1 2007/4885DPP9 4192/4885
US-20170081341-A1 BENZOXAZEPIN PI3K INHIBITOR COMPOUNDS AND METHODS OF USE BMX, PIK3CA, PI4KA DPP4 2923/4885PITRM1 2007/4885DPP9 4192/4885

“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.