SCHEMBL3576113

SCHEMBL3576113

O=C(O)[C@@H]1C[C@@H](c2ccccc2)CN1C(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FABP5 Q01469 3/20 0.54
FABP7 O15540 2/20 0.54
KMT2A Q03164 3/20 0.41
ACE P12821 2/20 0.39
EPHX2 P34913 1/20 0.39
AGTR2 P50052 4/20 0.38
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
MEN1 O00255 1/20 0.37
HTRA1 Q92743 1/20 0.37

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
SCHEMBL5157204 1.00 FABP5 (0.54) FABP5FABP7KMT2AACEEPHX2
SCHEMBL30510365 1.00 FABP5 (0.54) FABP5FABP7KMT2AACEEPHX2
SCHEMBL30510380 1.00 FABP5 (0.54) FABP5FABP7KMT2AACEEPHX2
SCHEMBL6558488 1.00 FABP5 (0.54) FABP5FABP7KMT2AACEEPHX2
SCHEMBL1830867 1.00 FABP5 (0.54) FABP5FABP7KMT2AACEEPHX2
SCHEMBL30510279 1.00 FABP5 (0.54) FABP5FABP7KMT2AACEEPHX2
SCHEMBL4612189 0.86 FABP5 (0.46) FABP5FABP7KMT2AACEEPHX2
SCHEMBL1335555 0.86 FABP5 (0.46) FABP5FABP7KMT2AACEEPHX2
SCHEMBL1334889 0.86 FABP5 (0.46) FABP5FABP7KMT2AACEEPHX2
SCHEMBL16153163 0.86 FABP5 (0.46) FABP5FABP7KMT2AEPHX2AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-09 US disclosed
US-11912794-B2 Modulation of structured polypeptide specificity Bicyclerd Limited (GB) 2024-02-27 US disclosed
EP-4316503-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-02-07 EP disclosed
US-11753444-B2 Modulation of structured polypeptide specificity Bicyclerd Limited (GB) 2023-09-12 US disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 US disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 US disclosed
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-05-18 US disclosed
US-20210122786-A1 MODULATION OF STRUCTURED POLYPEPTIDE SPECIFICITY Bicyclerd Limited (GB) 2021-04-29 US disclosed
US-20210079043-A1 MODULATION OF STRUCTURED POLYPEPTIDE SPECIFICITY Bicyclerd Limited (GB) 2021-03-18 US disclosed
US-10870679-B2 Modulation of structured polypeptide specificity Bicyclerd Limited (GB) 2020-12-22 US disclosed
WO-2013050616-A1 MODULATION OF STRUCTURED POLYPEPTIDE SPECIFICITY BICYCLE THERAPEUTICS LIMITED (GB) 2013-04-11 WO disclosed
US-20130028843-A1 KALLIKREIN 7 MODULATORS NOVARTIS AG (CH) 2013-01-31 US disclosed
US-8309596-B2 Kallikrein 7 modulators NOVARTIS AG (CH) 2012-11-13 US disclosed
US-20100256144-A1 Kallikrein 7 modulators NOVARTIS AG (CH) 2010-10-07 US disclosed
EP-2170939-A1 KALLIKREIN 7 MODULATORS Novartis Ag (CH) 2010-04-07 EP disclosed
WO-2009000878-A1 KALLIKREIN 7 MODULATORS NOVARTIS AG (CH) 2008-12-31 WO disclosed
US-7119073-B2 Peptides and their use as inhibitors of hepatitis C virus ns3 protease ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2006-10-10 US disclosed
US-20040142876-A1 Peptides and their use as inhibitors of hepatitis c virus ns3 protease ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P ANGELETTI SPA (IT) 2004-07-22 US disclosed
EP-1392721-A1 PEPTIDES AND THEIR USE AS INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI S.P.A. (IT) 2004-03-03 EP disclosed
WO-2002079234-A1 PEPTIDES AND THEIR USE AS INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2002-10-10 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 (8 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-20130028843-A1 KALLIKREIN 7 MODULATORS KLK7, KLK5, KLKB1 FABP5 1798/4885FABP7 1276/4885KMT2A 1804/4885
US-20040142876-A1 Peptides and their use as inhibitors of hepatitis c virus ns3 protease CTRL, VIP, CTSC FABP5 2372/4885FABP7 2788/4885KMT2A 4234/4885
US-20230151060-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS FABP5 4094/4885FABP7 4602/4885KMT2A 3145/4885
US-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND VIP, IAPP, KRAS FABP5 4026/4885FABP7 4376/4885KMT2A 4757/4885
US-10870679-B2 Modulation of structured polypeptide specificity KLKB1, KLK5, KLK1 FABP5 135/4885FABP7 204/4885KMT2A 3367/4885
US-20100256144-A1 Kallikrein 7 modulators KLK7, KLK5, KLKB1 FABP5 1798/4885FABP7 1276/4885KMT2A 1804/4885
US-11753444-B2 Modulation of structured polypeptide specificity KLKB1, KLK5, KLK1 FABP5 135/4885FABP7 204/4885KMT2A 3367/4885
US-20210079043-A1 MODULATION OF STRUCTURED POLYPEPTIDE SPECIFICITY KLKB1, KLK5, KLK1 FABP5 135/4885FABP7 204/4885KMT2A 3367/4885

“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.