Pemetrexed

Pemetrexed

SCHEMBL1933385

Nc1nc2[nH]cc(CCc3ccc(C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])cc3)c2c(=O)[nH]1.[Na+].[Na+]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DHFRGARTTYMSthyA

The experimentally established mechanism targets of Pemetrexed. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TYMS known ✓ P04818 8/20 1.00
GART known ✓ P22102 8/20 0.75
DHFR known ✓ P00374 4/20 0.75
FOLR1 P15328 7/20 0.75
SLC46A1 Q96NT5 7/20 0.75
SLC19A1 P41440 6/20 0.75
FOLR2 P14207 3/20 0.75
ATIC P31939 2/20 0.75
SHMT1 P34896 1/20 0.75
FRK P42685 1/20 0.75

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
Pemetrexed SCHEMBL6076020 1.00 TYMS (1.00) TYMSGARTFOLR1SLC46A1SLC19A1
Pemetrexed SCHEMBL6075234 0.99 TYMS (0.98) TYMSGARTFOLR1SLC46A1SLC19A1
Pemetrexed SCHEMBL6075227 0.99 TYMS (0.98) TYMSGARTFOLR1SLC46A1SLC19A1
SCHEMBL7143669 0.94 TYMS (0.89) TYMSGARTFOLR1SLC46A1SLC19A1
Pemetrexed SCHEMBL18348 0.88 TYMS (0.78) TYMSGARTFOLR1SLC46A1SLC19A1
Pemetrexed SCHEMBL1651788 0.88 TYMS (0.78) TYMSGARTFOLR1SLC46A1SLC19A1
Pemetrexed SCHEMBL5333210 0.88 TYMS (0.78) TYMSGARTFOLR1SLC46A1SLC19A1
Pemetrexed SCHEMBL1934530 0.87 TYMS (0.77) TYMSGARTFOLR1SLC46A1SLC19A1
Pemetrexed SCHEMBL21599244 0.87 TYMS (0.77) TYMSGARTFOLR1SLC46A1SLC19A1
Pemetrexed SCHEMBL135815 0.87 TYMS (0.77) TYMSGARTFOLR1SLC46A1SLC19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118619955-A Preparation method and application of pemetrexed key intermediate 江苏海洋大学 2024-09-10 CN claimed
US-20220089570-A1 IMIDE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE Arvinas, Inc. 2022-03-24 US claimed
US-7138521-B2 Crystalline of N-[4-[2-(2-Amino-4,7-dihydro-4oxo-3H-pyrrolo[2,3-D]pyrimidin-5-YL)ethyl]benzoyl]-L-glutamic acid and process therefor ELI LILLY AND COMPANY (US) 2006-11-21 US claimed
US-20030216416-A1 Novel crystalline of n-[4-[2-(2-amino-4,7-dihydro-4oxo-3h-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-l-glutamic acid and process therefor ELI LILLY AND COMPANY 2003-11-20 US claimed
JP-2003530321-A 2003-10-14 JP claimed
EP-1259513-B1 A NOVEL CRYSTALLINE FORM OF N- 4- 2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO 2,3-d]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID AND PROCESS THEREFOR LILLY CO ELI (US) 2003-09-10 EP claimed
EP-1259513-A2 A NOVEL CRYSTALLINE FORM OF N- 4- 2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO 2,3-d]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID AND PROCESS THEREFOR ELI LILLY AND COMPANY (US) 2002-11-27 EP claimed
EP-1212325-A2 A NOVEL CRYSTALLINE FORM OF DISODIUM N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]-PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID SALT AND PROCESSES THEREFOR ELI LILLY AND COMPANY (US) 2002-06-12 EP claimed
WO-2001062760-A2 A NOVEL CRYSTALLINE FORM OF N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-d]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID AND PROCESS THEREFOR ELI LILLY AND COMPANY (US) 2001-08-30 WO claimed
WO-2001014379-A2 A NOVEL CRYSTALLINE FORM OF DISODIUM N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]-PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID SALT AND PROCESSES THEREFOR ELI LILLY AND COMPANY (US) 2001-03-01 WO claimed
CN-116723837-B Solid forms of CDK2 inhibitors PFIZER INC. (US) 2026-05-26 CN disclosed
CN-121287594-A Sustained release implant containing pemetrexed and application thereof 江苏泰中药业有限公司 2026-01-09 CN disclosed
US-20250228788-A1 COMPOSITIONS AND METHODS FOR ORGAN SPECIFIC DELIVERY OF NUCLEIC ACIDS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-07-17 US disclosed
CN-114085238-B Preparation method of high-purity pemetrexed disodium dimer impurity 重庆凯林制药有限公司 2025-06-10 CN disclosed
US-20250170067-A1 Carrier-Binding Agent Compositions and Methods of Making and Using the Same MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2025-05-29 US disclosed
EP-1212325-A2 A NOVEL CRYSTALLINE FORM OF DISODIUM N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]-PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID SALT AND PROCESSES THEREFOR ELI LILLY AND COMPANY (US) 2002-06-12 EP disclosed
WO-2001014379-A3 A NOVEL CRYSTALLINE FORM OF DISODIUM N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]-PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID SALT AND PROCESSES THEREFOR LILLY CO ELI (US) 2001-09-07 WO disclosed
WO-2001062760-A2 A NOVEL CRYSTALLINE FORM OF N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-d]PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID AND PROCESS THEREFOR ELI LILLY AND COMPANY (US) 2001-08-30 WO disclosed
WO-2001014379-A2 A NOVEL CRYSTALLINE FORM OF DISODIUM N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]-PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID SALT AND PROCESSES THEREFOR ELI LILLY AND COMPANY (US) 2001-03-01 WO disclosed
WO-2001014379-A2 A NOVEL CRYSTALLINE FORM OF DISODIUM N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]-PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID SALT AND PROCESSES THEREFOR ELI LILLY AND COMPANY (US) 2001-03-01 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-20220089570-A1 IMIDE-BASED MODULATORS OF PROTEOLYSIS AND ASSOCIATED METHODS OF USE CRBN, MDM2, UBE2N TYMS 2998/4885GART 2409/4885DHFR 2391/4885
US-20030216416-A1 Novel crystalline of n-[4-[2-(2-amino-4,7-dihydro-4oxo-3h-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]-l-glutamic acid and process therefor SLC7A11, SLC7A1, DHFR TYMS 119/4885GART 71/4885DHFR 3/4885
US-20250228788-A1 COMPOSITIONS AND METHODS FOR ORGAN SPECIFIC DELIVERY OF NUCLEIC ACIDS POLRMT, FABP1, SNRPE TYMS 2122/4885GART 3414/4885DHFR 1967/4885

“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.