SCHEMBL3688868

SCHEMBL3688868

N=C(N)NCCC[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SSTR3 P32745 1/20 0.52
▸ MMP2 P08253 1/20 0.48
▸ PDF Q9HBH1 1/20 0.45
▸ NPY4R P50391 7/20 0.45
▸ NPY1R P25929 5/20 0.45
▸ NPY2R P49146 3/20 0.45
▸ NPY5R Q15761 3/20 0.45
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ MAPT P10636 2/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ MAOA P21397 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ KISS1R Q969F8 1/20 0.42

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
Hydrochloric Acid SCHEMBL31023226 0.99 SSTR3 (0.51) SSTR3MMP2PDFNPY4RNPY1R
Hydrochloric Acid SCHEMBL6383627 0.99 SSTR3 (0.51) SSTR3MMP2PDFNPY4RNPY1R
SCHEMBL11361946 0.96 SSTR3 (0.51) SSTR3MMP2PDFNPY4RNPY1R
SCHEMBL8128688 0.93 SSTR3 (0.49) SSTR3MMP2PDFNPY4RNPY1R
SCHEMBL30073980 0.92 SSTR3 (0.47) SSTR3MMP2PDFMEN1KMT2A
SCHEMBL16446037 0.90 PDF (0.50) SSTR3MMP2PDFNPY4RNPY1R
SCHEMBL29700074 0.88 NPY4R (0.53) MMP2NPY4RNPY1RNPY2RNPY5R
SCHEMBL8722659 0.88 PDF (0.48) SSTR3PDFNPY4RNPY1RNPY2R
SCHEMBL30541924 0.86 KISS1R (0.52) SSTR3NPY4RNPY1RNPY2RNPY5R
SCHEMBL30541925 0.86 SSTR3 (0.56) SSTR3PDFNPY4RNPY1RNPY2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4445138-A1 FRET ENZYMATIC SUBSTRATE AND USES THEREOF IN LUNG CANCER Urteste S.A. (PL) 2024-10-16 — — EP disclosed
WO-2023106945-A1 FRET ENZYMATIC SUBSTRATE AND USES THEREOF IN LUNG CANCER. URTESTE S.A. (PL) 2023-06-15 — — WO disclosed
EP-2183277-A1 SEX-PEPTIDES RESISTANT TO PROTEOLYTIC DEGRADATION AND THEIR USE IN BIOLOGICAL CONTROL OF INSECTS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2010-05-12 — — EP disclosed
WO-2009016627-A1 SEX-PEPTIDES RESISTANT TO PROTEOLYTIC DEGRADATION AND THEIR USE IN BIOLOGICAL CONTROL OF INSECTS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2009-02-05 — — WO disclosed
EP-1011666-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2004-03-31 — — EP disclosed
EP-0980367-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2003-03-19 — — EP disclosed
EP-1244655-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2002-10-02 — — EP disclosed
EP-0993300-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2002-07-31 — — EP disclosed
EP-0973517-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2002-07-24 — — EP disclosed
EP-1019047-A4 ANTITHROMBOTIC AGENTS LILLY CO ELI (US) 2001-06-13 — — EP disclosed
EP-0973517-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 2000-01-26 — — EP disclosed
WO-1998051684-A1 ANTITHROMBOTIC COMPOUND ELI LILLY AND COMPANY (US) 1998-11-19 — — WO disclosed
WO-1998048798-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 — — WO disclosed
WO-1998048794-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 — — WO disclosed
WO-1998049161-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 — — WO disclosed
WO-1998048797-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 — — WO disclosed
WO-1998049160-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 — — WO disclosed
WO-1998048804-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 — — WO disclosed
WO-1998048800-A1 ANTITHROMBOTIC AGENTS ELI LILLY AND COMPANY (US) 1998-11-05 — — WO disclosed
WO-1998029144-A1 METHOD FOR PREPARING A BIOLOGICAL GLUE INOTEB (FR) 1998-07-09 — — WO disclosed
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