SCHEMBL5665191

SCHEMBL5665191

N=C(N)Nc1ccc(C[C@H](N)C=O)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 4/20 0.35
F2 P00734 3/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
TMPRSS6 Q8IU80 1/20 0.35
ST14 Q9Y5Y6 1/20 0.35
PLG P00747 3/20 0.34
PLAU P00749 3/20 0.34
PLAT P00750 3/20 0.34
KLKB1 P03952 3/20 0.34
LTA4H P09960 1/20 0.34
ITGB3 P05106 2/20 0.34
ITGA2B P08514 2/20 0.34
ROCK2 O75116 1/20 0.34
ITGAV P06756 1/20 0.34
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33

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
SCHEMBL20715008 1.00 PRSS1 (0.35) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL5974342 0.82 SLC1A3 (0.40) LTA4HITGB3ITGA2BROCK2ITGAV
SCHEMBL2270750 0.81 SMN1; SMN2 (0.52) KDM4EMEN1NPC1RAB9AKMT2A
SCHEMBL2267539 0.81 SMN1; SMN2 (0.52) KDM4EMEN1NPC1RAB9AKMT2A
SCHEMBL27690799 0.81 SMN1; SMN2 (0.52) KDM4EMEN1NPC1RAB9AKMT2A
SCHEMBL15213080 0.80 CAPN1 (0.35) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL14669314 0.78 ROCK2 (0.38) ROCK2GAAKDM4ENPC1RAB9A
SCHEMBL7450129 0.78 PRSS1 (0.50) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL7140360 0.78 PRSS1 (0.50) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL8952285 0.78 PRSS1 (0.50) PRSS1F2PRSS2PRSS3TMPRSS6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050124548-A1 Peptide antiangiogenic drugs HENKIN JACK (US) 2005-06-09 US claimed
US-6777535-B1 USEFUL FOR TREATING CONDITIONS WHICH ARISE OR ARE EXACERBATED BY ANGIOGENESIS ABBOTT LABORATORIES 2004-08-17 US claimed
US-6753408-B1 DRUGS USED FOR THERAPY ABBVIE INC. 2004-06-22 US claimed
US-6716963-B1 OLIGOPEPTIDES ABBOTT LABORATORIES 2004-04-06 US claimed
EP-1242455-A1 N-ALKYLATED PEPTIDES HAVING ANTIANGIOGENIC ACTIVITY Abbott Laboratories (US) 2002-09-25 EP claimed
EP-1232183-A2 PEPTIDES HAVING ANTIANGIOGENIC ACTIVITY ABBOTT LABORATORIES (US) 2002-08-21 EP claimed
WO-2001038397-A1 N-ALKYLATED PEPTIDES HAVING ANTIANGIOGENIC ACTIVITY ABBOTT LABORATORIES (US) 2001-05-31 WO claimed
WO-2001038347-A2 PEPTIDES HAVING ANTIANGIOGENIC ACTIVITY ABBOTT LABORATORIES (US) 2001-05-31 WO claimed
EP-1078002-A1 PEPTIDE ANTIANGIOGENIC DRUGS ABBOTT LABORATORIES (US) 2001-02-28 EP claimed
WO-1999061476-A1 PEPTIDE ANTIANGIOGENIC DRUGS ABBOTT LABORATORIES (US) 1999-12-02 WO claimed
US-5760002-A ANALGESICS THE PROCTOR & GAMBLE COMPANY (US) 1998-06-02 US claimed
US-5663297-A OLIGOPEPTIDES HOFFMANN-LA ROCHE INC. (US) 1997-09-02 US claimed
EP-3052121-B1 WNT COMPOSITIONS AND METHODS FOR PURIFICATION UNIV LELAND STANFORD JUNIOR (US) 2023-02-22 EP disclosed
US-20190256559-A1 PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF AILERON THERAPEUTICS, INC. 2019-08-22 US disclosed
US-20170281720-A1 PEPTIDOMIMETIC MACROCYCLES HOFFMANN-LA ROCHE, INC. 2017-10-05 US disclosed
WO-2017044633-A1 PEPTIDOMIMETIC MACROCYCLES AS MODULATORS OF MCL-1 AILERON THERAPEUTICS, INC. (US) 2017-03-16 WO disclosed
WO-1999061476-A1 PEPTIDE ANTIANGIOGENIC DRUGS ABBOTT LABORATORIES (US) 1999-12-02 WO disclosed
US-5760002-A ANALGESICS THE PROCTOR & GAMBLE COMPANY (US) 1998-06-02 US disclosed
EP-0675901-A1 DIFLUORO-PENTAPEPTIDE DERIVATIVE ANTI-INFLAMMATORY AGENTS THE PROCTER & GAMBLE COMPANY (US) 1995-10-11 EP disclosed
WO-1994014842-A1 DIFLUORO-PENTAPEPTIDE DERIVATIVE ANTI-INFLAMMATORY AGENTS THE PROCTER & GAMBLE COMPANY (US) 1994-07-07 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 (3 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-20050124548-A1 Peptide antiangiogenic drugs VEGFA, NPPA, FLT1 PRSS1 1391/4885F2 371/4885PRSS2 2352/4885
US-20190256559-A1 PEPTIDOMIMETIC MACROCYCLES AND USES THEREOF TP53, TP53BP1, MDM2 PRSS1 658/4885F2 1153/4885PRSS2 423/4885
US-20170281720-A1 PEPTIDOMIMETIC MACROCYCLES TP53, MDM2, MDM4 PRSS1 1749/4885F2 2798/4885PRSS2 1669/4885

“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.