SCHEMBL4327210

SCHEMBL4327210

CNCC(=O)N1CCC[C@H]1C(=O)NCC(N)=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FAP Q12884 6/20 0.41
PREP P48147 6/20 0.41
DPP4 P27487 5/20 0.41
ACE P12821 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
F2 P00734 5/20 0.39
PRSS1 P07477 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
PKM P14618 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL4330609 1.00 FAP (0.41) FAPPREPDPP4ACENPSR1
SCHEMBL464681 0.87 PREP (0.55) FAPPREPDPP4NPSR1F2
SCHEMBL1046072 0.85 DPP4 (0.46) FAPPREPDPP4ACENPSR1
SCHEMBL1046070 0.85 DPP4 (0.46) FAPPREPDPP4ACENPSR1
SCHEMBL20908682 0.84 F2 (0.48) FAPPREPDPP4NPSR1F2
SCHEMBL21779485 0.83 DPP4 (0.47) FAPPREPDPP4ACE
SCHEMBL12809058 0.83 DPP4 (0.47) FAPPREPDPP4ACE
SCHEMBL11515849 0.82 F2 (0.40) FAPPREPDPP4NPSR1F2
SCHEMBL11515844 0.82 F2 (0.40) FAPPREPDPP4NPSR1F2
SCHEMBL11111422 0.81 CHRM2 (0.40) FAPPREPDPP4NPSR1F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170953-A1 INDENTIFICATION OF COMPOUNDS THAT INHIBIT REPLICATION OF HUMAN IMMUNODEFICIENCY VIRUS TRIPEP AB (SE) 2009-07-02 US disclosed
CN-100382795-C Glycinamide derivative for inhibiting HIV replication TRIPEP AB (SE) 2008-04-23 CN disclosed
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide CHRONTECH PHARMA AB (SE) 2008-03-27 US disclosed
EP-1799222-A2 COMPOUNDS THAT INHIBIT REPLICATION OF HUMAN IMMUNODEFICIENCY VIRUS TRIPEP AB (SE) 2007-06-27 EP disclosed
US-20060188920-A1 enzymatically or synthetically prepared alpha-hydroxyglycinamide inhibit the replication of HIV in human serum BALZARINI JAN MARIA R 2006-08-24 US disclosed
US-20060183748-A1 alpha-hydroxyglycinamide derivatives eg alpha -hydroxy-glycinamide hydrochloride BALZARINI JAN MARIA R 2006-08-17 US disclosed
CN-1777414-A Glycinamide derivative for inhibiting HIV replication TRIPEP AB (SE) 2006-05-24 CN disclosed
WO-2006030323-A2 COMPOUNDS THAT INHIBIT REPLICATION OF HUMAN IMMUNODEFICIENCY VIRUS TRIPEP AB (SE) 2006-03-23 WO disclosed
EP-1603546-A1 GLYCINAMIDE DERIVATIVE FOR INHIBITING HIV REPLICATION Tripep AB (SE) 2005-12-14 EP disclosed
US-20050096319-A1 Identification of compounds that inhibit replication of human immunodeficiency virus TRIPEP AB (SE) 2005-05-05 US disclosed
US-20040180893-A1 enzymatically or synthetically prepared alpha-hydroxyglycinamide inhibit the replication of HIV in human serum TRIPEP AB (SE) 2004-09-16 US disclosed
WO-2004073703-A1 GLYCINAMIDE DERIVATIVE FOR INHIBITING HIV REPLICATION TRIPEP AB (SE) 2004-09-02 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-20060183748-A1 alpha-hydroxyglycinamide derivatives eg alpha -hydroxy-glycinamide hydrochloride GALE, ENGASE, GLMN FAP 1534/4885PREP 35/4885DPP4 625/4885
US-20050096319-A1 Identification of compounds that inhibit replication of human immunodeficiency virus GALE, ENGASE, GLMN FAP 1297/4885PREP 16/4885DPP4 449/4885
US-20080076824-A1 modified glycinamides: Valine-alphahydroxy-glycinamide GALE, ENGASE, UGGT1 FAP 1312/4885PREP 7/4885DPP4 725/4885
US-20040180893-A1 enzymatically or synthetically prepared alpha-hydroxyglycinamide inhibit the replication of HIV in human serum ENGASE, GALE, OGA FAP 1000/4885PREP 10/4885DPP4 380/4885
US-20090170953-A1 INDENTIFICATION OF COMPOUNDS THAT INHIBIT REPLICATION OF HUMAN IMMUNODEFICIENCY VIRUS OGA, ENGASE, GALE FAP 1612/4885PREP 21/4885DPP4 320/4885

“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.