SCHEMBL178787

SCHEMBL178787

CCC(NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 3/20 0.60
TP53 P04637 3/20 0.60
CASP3 P42574 2/20 0.57
TLR2 O60603 2/20 0.54
MDM2 Q00987 4/20 0.53
KMT2A Q03164 2/20 0.52

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
SCHEMBL30353997 1.00 MDM4 (0.60) MDM4TP53CASP3TLR2MDM2
SCHEMBL29378420 1.00 MDM4 (0.60) MDM4TP53CASP3TLR2MDM2
SCHEMBL30191581 1.00 MDM4 (0.60) MDM4TP53CASP3TLR2MDM2
SCHEMBL119339 1.00 MDM4 (0.60) MDM4TP53CASP3TLR2MDM2
SCHEMBL29401430 1.00 MDM4 (0.60) MDM4TP53CASP3TLR2MDM2
SCHEMBL31675022 1.00 MDM4 (0.60) MDM4TP53CASP3TLR2MDM2
SCHEMBL29792126 1.00 MDM4 (0.60) MDM4TP53CASP3TLR2MDM2
SCHEMBL118051 1.00 MDM4 (0.60) MDM4TP53CASP3TLR2MDM2
Water SCHEMBL21809391 0.99 MDM4 (0.59) MDM4TP53CASP3TLR2MDM2
SCHEMBL22636280 0.93 MDM4 (0.59) MDM4TP53CASP3TLR2MDM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US claimed
CN-117924431-A Natural cyclopeptide zelkovamycins simplified substance and preparation method and application thereof 北流市中医医院 2024-04-26 CN claimed
CN-110305042-A N α-fluorenylmethyloxycarbonyl-N γ-(4,4- dimethyl -2,6- dioxo hexamethylene subunit) ethyl-butyric acid preparation method 吉尔生化(上海)有限公司 2019-10-08 CN claimed
EP-4512818-A1 CYCLIC COMPOUND HAVING SELECTIVE KRAS INHIBITORY EFFECT ON HRAS AND NRAS Chugai Seiyaku Kabushiki Kaisha (JP) 2025-02-26 EP disclosed
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES PEPTIDREAM INC (JP) 2024-12-05 US disclosed
EP-4371982-A2 MACROCYCLIC BROAD SPECTRUM ANTIBIOTICS RQX Pharmaceuticals, Inc. (US) 2024-05-22 EP disclosed
US-20240158446-A1 CYCLIC COMPOUND HAVING SELECTIVE INHIBITORY ACTION ON KRAS OVER HRAS AND NRAS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-16 US disclosed
US-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-05-09 US disclosed
CN-117924431-A Natural cyclopeptide zelkovamycins simplified substance and preparation method and application thereof 北流市中医医院 2024-04-26 CN 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-5866592-A Fibrinogen receptor antagonist and pharmaceutical compositions comprising the same NIPPON STEEL CORPORATION (JP) 1999-02-02 US disclosed
EP-0846950-A2 Peptides useful as internal standards for microsequencing and method for their use THE UNITED STATES GOVERNMENT as represented by THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-06-10 EP disclosed
EP-0651883-B1 PEPTIDES USEFUL AS INTERNAL STANDARDS FOR MICROSEQUENCING AND METHODS FOR THEIR USE US HEALTH (US) 1998-05-13 EP disclosed
EP-0800516-A1 FIBRINOGEN RECEPTOR ANTAGONISTS HAVING SUBSTITUTED (b)-AMINO ACID RESIDUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME NIPPON STEEL CORPORATION (JP) 1997-10-15 EP disclosed
WO-1997022589-A1 BENZAMIDE DERIVATIVES AS THROMBIN INHIBITORS GLAXO GROUP LIMITED (GB) 1997-06-26 WO disclosed
US-5589397-A SIMULTANEOUSLY SEQUENCING INTERNAL STANDARD COMPRISING PEPTIDE CONSISTING OF UNNATURAL AMINO ACID RESIDUES AND UNKNOWN PEPTIDE IN SEQUENCER TO PRODUCE CHROMATOGRAM, COMPARING RETENTION TIMES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-12-31 US disclosed
WO-1996020172-A1 FIBRINOGEN RECEPTOR ANTAGONISTS HAVING SUBSTITUTED β-AMINO ACID RESIDUES AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME NIPPON STEEL CORPORATION (JP) 1996-07-04 WO disclosed
EP-0651883-A1 PEPTIDES USEFUL AS INTERNAL STANDARDS FOR MICROSEQUENCING AND METHODS FOR THEIR USE THE GOVERNMENT OF THE UNITED STATES OF AMERICA, as represented by THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1995-05-10 EP disclosed
WO-1994002856-A1 PEPTIDES USEFUL AS INTERNAL STANDARDS FOR MICROSEQUENCING AND METHODS FOR THEIR USE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1994-02-03 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-20240158446-A1 CYCLIC COMPOUND HAVING SELECTIVE INHIBITORY ACTION ON KRAS OVER HRAS AND NRAS KRAS, HRAS, NRAS MDM4 476/4885TP53 10/4885CASP3 3300/4885
US-20240148821-A1 PHARMACEUTICAL USE OF CYCLIC PEPTIDE COMPOUND VIP, IAPP, KRAS MDM4 1294/4885TP53 178/4885CASP3 3268/4885
US-20240400499-A1 NOVEL AMINO ACID DERIVATIVES BCAT1, BCAT2, PELP1 MDM4 2155/4885TP53 3262/4885CASP3 4451/4885

“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.