SCHEMBL6850997

SCHEMBL6850997

N=C(N)NCCC[C@@H](C=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F2 P00734 3/20 0.57
PLG P00747 2/20 0.57
OPRM1 P35372 3/20 0.49
OPRD1 P41143 2/20 0.49
OPRK1 P41145 1/20 0.49
F10 P00742 1/20 0.46
PRSS1 P07477 1/20 0.46

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
SCHEMBL7356254 1.00 F2 (0.57) F2PLGOPRM1OPRD1OPRK1
SCHEMBL6850981 1.00 F2 (0.57) F2PLGOPRM1OPRD1OPRK1
SCHEMBL7356276 1.00 F2 (0.57) F2PLGOPRM1OPRD1OPRK1
SCHEMBL27532662 1.00 F2 (0.57) F2PLGOPRM1OPRD1OPRK1
Acetic Acid SCHEMBL10728075 0.99 F2 (0.56) F2PLGOPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL11285878 0.99 F2 (0.56) F2PLGOPRM1OPRD1OPRK1
Sulfuric Acid SCHEMBL7264620 0.97 F2 (0.54) F2PLGOPRM1OPRD1OPRK1
Hydrochloric Acid SCHEMBL7304367 0.92 OPRM1 (0.49) F2PLGOPRM1OPRD1
Hydrochloric Acid SCHEMBL7296655 0.90 F2 (0.59) F2PLGOPRM1OPRK1F10
SCHEMBL7395037 0.90 F2 (0.53) F2PLGOPRM1OPRK1F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1025738-C Process for preparing peptide-aldehydes and compositions thereof INST MED PUBLIC ENTERPR (HU) 1994-08-24 CN claimed
CN-85109736-A Process for preparing peptide-aldehydes and compositions thereof 1987-03-18 CN claimed
EP-3466961-B1 PROLINAMIDE DERIVATIVE AS THROMBIN INHIBITOR LI MIN (US) 2022-04-06 EP disclosed
US-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 US disclosed
WO-2001079195-A9 PYRIDINE AND PYRAZINE DERIVATIVES AS THROMBIN INHIBITORS CORVAS INT INC (US) 2003-10-23 WO disclosed
US-6608204-B1 Peptide aldehyde having arginine or arginine mimics at P1 and pyridone, pyrimidone, or uracil groups; antithrombosis agents CORVAS INTERNATIONAL, INC. 2003-08-19 US disclosed
US-20030092679-A1 Novel non-convalent thrombin inhibitors DENDREON PHARMACEUTICALS LLC 2003-05-15 US disclosed
EP-0846682-B9 PENICILLAMINAMIDE DERIVATIVES MITSUBISHI CHEM CORP (JP) 2003-05-14 EP disclosed
US-6541467-B1 And at P1 have a six-membered heterocyclic ring having two ring nitrogen ring atoms and the remainder of the ring atoms carbon atoms. CORVAS INTERNATIONAL, INC. 2003-04-01 US disclosed
US-6506761-B1 Compound of the invention are active as inhibitors of Thrombin and are useful in treating disease states in mammals which are characterized by abnormal thrombosis and have the following structure: CORVAS INTERNATIONAL, INC. 2003-01-14 US disclosed
US-6506760-B1 Compounds of the invention are active as inhibitors of Thrombin and are useful in treating disease states in mammals which are characterized by abnormal thrombosis and have the following structure: CORVAS INTERNATIONAL, INC. 2003-01-14 US disclosed
EP-0508220-A1 Derivatives of amindinophenylalanine, procedure for their preparation, their utilisation and compositions comprising them BEHRINGWERKE Aktiengesellschaft (DE) 1992-10-14 EP disclosed
US-5153176-A Substituted lysine-proline-arginine peptide NITTO BOSEKI CO., LTD. (JP) 1992-10-06 US disclosed
EP-0185390-B1 TRIPEPTIDYL-ARGININALDEHYDE, PROCESS FOR ITS PREPARATION AND MEDICAMENTS THEREOF, AS WELL AS N-(MONOALKYL) AND N,N-DI-(ALKYL)-XXX-L-PROLINE DIPEPTIDE RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1991-10-02 EP disclosed
US-4703036-A ANTICOAGULANTS RICHTER GEDEON VEGYESZETI GYAR RT (HU) 1987-10-27 US disclosed
CN-85109736-A Process for preparing peptide-aldehydes and compositions thereof 1987-03-18 CN disclosed
US-4478745-A ANTICOAGULANTS RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1984-10-23 US disclosed
US-4478745-A ANTICOAGULANTS RICHTER GEDEON VEGYESZETI GYAR R.T. (HU) 1984-10-23 US disclosed
US-4399065-A AQUEOUS SOLUTION, NATICOAGULANT PATENTBUREAU DANUBIA (HU) 1983-08-16 US disclosed
US-4399065-A AQUEOUS SOLUTION, NATICOAGULANT PATENTBUREAU DANUBIA (HU) 1983-08-16 US 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 (1 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-20030092679-A1 Novel non-convalent thrombin inhibitors F2, SERPINC1, F2RL3 F2 1/4885PLG 13/4885OPRM1 4681/4885

“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.