SCHEMBL417979

SCHEMBL417979

NC(=O)N1CCNC(=O)C1=O

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.37
ALDH1A1 P00352 3/20 0.36
POLB P06746 1/20 0.36
FAAH O00519 1/20 0.35
NAAA Q02083 1/20 0.35
MAPT P10636 1/20 0.34
RPS6KA3 P51812 1/20 0.34
GAA P10253 2/20 0.33
HSD17B10 Q99714 1/20 0.31
NOS1 P29475 1/20 0.31
CYP11B2 P19099 1/20 0.30

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
SCHEMBL912170 0.81 ALDH1A1 (0.40) NPSR1ALDH1A1POLBFAAHNAAA
SCHEMBL6639420 0.80
SCHEMBL29654087 0.80 NPSR1 (0.35) NPSR1ALDH1A1POLBFAAHNAAA
SCHEMBL5529311 0.79 NPSR1 (0.41) NPSR1ALDH1A1POLBFAAHNAAA
SCHEMBL9781917 0.79 ALDH1A1 (0.40) NPSR1ALDH1A1POLBFAAHNAAA
SCHEMBL8166868 0.79 NPSR1 (0.37) NPSR1ALDH1A1POLBFAAHNAAA
SCHEMBL4971017 0.79 FAAH (0.39) NPSR1ALDH1A1POLBFAAHNAAA
SCHEMBL30016924 0.76 NPSR1 (0.36) NPSR1ALDH1A1POLBFAAHNAAA
SCHEMBL11076055 0.75 FAAH (0.46) NPSR1ALDH1A1POLBFAAHNAAA
SCHEMBL11027876 0.75 KMT2A (0.44) NPSR1ALDH1A1POLBFAAHNAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118344557-A Diketopiperazine-based polyurethane elastomer and preparation method and application thereof 天津科技大学 2024-07-16 CN disclosed
CN-105616414-B A kind of new application of oxypiperazin amides compound 湘北威尔曼制药股份有限公司 2019-03-05 CN disclosed
US-10039760-B2 Method of using diketopiperazines and composition containing them AMPIO PHARMACEUTICALS, INC. (US) 2018-08-07 US disclosed
US-20170209433-A1 METHOD OF USING DIKETOPIPERAZINES AND COMPOSITION CONTAINING THEM DMI ACQUISITION CORP. 2017-07-27 US disclosed
US-9561226-B2 Method of using diketopiperazines and composition containing them AMPIO PHARMACEUTICALS, INC. (US) 2017-02-07 US disclosed
US-20150051223-A1 METHOD OF USING DIKETOPIPERAZINES AND COMPOSITION CONTAINING THEM DMI BIOSCIENCES, INC. 2015-02-19 US disclosed
US-8916568-B2 Method of using diketopiperazines and composition containing them AMPIO PHARMACEUTICALS, INC. (US) 2014-12-23 US disclosed
US-8841307-B2 Method of using diketopiperazines and composition containing them AMPIO PHARMACEUTICALS, INC. (US) 2014-09-23 US disclosed
US-20130345238-A1 METHOD OF USING DIKETOPIPERAZINES AND COMPOSITION CONTAINING THEM DMI ACQUISITION CORP. (US) 2013-12-26 US disclosed
US-8455517-B2 Method of using diketopiperazines and composition containing them DMI ACQUISITION CORP. (US) 2013-06-04 US disclosed
US-4822788-A MICROBIOCIDES, BETA-LACTAMASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-04-18 US disclosed
US-4782147-A ANTIBIOTIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-11-01 US disclosed
US-4725591-A USED WITH AMINO ACID DERIVATIVE ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-02-16 US disclosed
US-4675397-A MICROBIOCIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-06-23 US disclosed
US-4665067-A BACTERICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1987-05-12 US disclosed
US-4550105-A BETA-LACTAMASE INHIBITORS, ANTIBIOTICS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1985-10-29 US disclosed
EP-0053815-B1 2-OXOAZETIDINE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1985-05-08 EP disclosed
EP-0095764-A2 2-Oxoazetidinone derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1983-12-07 EP disclosed
EP-0053815-A1 2-Oxoazetidine derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1982-06-16 EP disclosed
EP-0050965-A1 Beta-lactamase inhibitory composition Takeda Chemical Industries, Ltd. (JP) 1982-05-05 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-20130345238-A1 METHOD OF USING DIKETOPIPERAZINES AND COMPOSITION CONTAINING THEM IL5, CXCL8, IL1B NPSR1 310/4885ALDH1A1 1439/4885POLB 4170/4885
US-20150051223-A1 METHOD OF USING DIKETOPIPERAZINES AND COMPOSITION CONTAINING THEM IL5, CXCL8, IL1B NPSR1 310/4885ALDH1A1 1439/4885POLB 4170/4885
US-10039760-B2 Method of using diketopiperazines and composition containing them IL5, CXCL8, IL1B NPSR1 310/4885ALDH1A1 1439/4885POLB 4170/4885
US-20170209433-A1 METHOD OF USING DIKETOPIPERAZINES AND COMPOSITION CONTAINING THEM IL5, CXCL8, IL1B NPSR1 310/4885ALDH1A1 1439/4885POLB 4170/4885

“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.