Pemetrexed

Pemetrexed

SCHEMBL124663

Nc1nc(=O)c2c(CCc3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)c[nH]c2[nH]1.[NaH]

nearest known ligand 0.76

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 11)

geneUniProtsupporting neighboursconfidence
GART known ✓ P22102 10/20 0.76
DHFR known ✓ P00374 6/20 0.76
TYMS known ✓ P04818 5/20 0.76
FOLR1 P15328 4/20 0.76
SLC46A1 Q96NT5 4/20 0.76
ATIC P31939 3/20 0.76
FOLR2 P14207 3/20 0.76
SLC19A1 P41440 3/20 0.76
SHMT1 P34896 2/20 0.76
FRK P42685 1/20 0.76
SHMT2 P34897 1/20 0.53

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 SCHEMBL108860 1.00 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL3760710 1.00 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL1934793 1.00 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL577951 0.99 GART (0.75) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL21600667 0.99 GART (0.75) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL15569564 0.99 GART (0.75) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL2549428 0.99 GART (0.77) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL7969 0.99 GART (0.77) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL7968 0.99 GART (0.77) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL6034765 0.99 GART (0.77) GARTDHFRTYMSFOLR1SLC46A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174991-B2 Crystalline form of pemetrexed disodium AZAD PHARMACEUTICAL INGREDIENTS AG (CH) 2015-11-03 US claimed
US-20120329819-A1 NEW CRYSTALLINE FORM OF PEMETREXED DISODIUM UNIVERSITY OF ZURICH (CH) 2012-12-27 US claimed
CN-101417998-B Purification method of pemetrexed salt CHONGQING PHARM RES INST CO 2012-10-24 CN claimed
EP-2504341-A1 A NEW CRYSTALLINE FORM OF PEMETREXED DISODIUM Azad Pharmaceutical Ingredients AG (CH) 2012-10-03 EP claimed
WO-2011064256-A1 A NEW CRYSTALLINE FORM OF PEMETREXED DISODIUM AZAD PHARMACEUTICAL INGREDIENTS AG (CH) 2011-06-03 WO claimed
CN-101417998-A Purification method of pemetrexed salt CHONGQING PHARM RES INST CO (CN) 2009-04-29 CN claimed
CN-119950395-A Local, sustained, controlled release implantable reservoirs for therapeutic agents for the treatment of cancer and related symptoms and conditions 铸造疗法股份有限公司 2025-05-09 CN disclosed
US-20250002526-A1 PHARMACEUTICAL COMPOSITION HAVING ANTI-CANCER IMMUNOSTIMULATING EFFECT AND/OR IMMUNE CHECKPOINT INHIBITION POTENTIATING EFFECT KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2025-01-02 US disclosed
US-12109232-B2 Radiation/chemotherapy sensitizer to be used for intratumoral local injection and for controlled release of hydrogen peroxide with hydrogel as carrier KORTUC INC. (JP) 2024-10-08 US disclosed
EP-4420666-A1 PHARMACEUTICAL COMPOSITION HAVING ANTI-CANCER IMMUNOSTIMULATING EFFECT AND/OR IMMUNE CHECKPOINT INHIBITION POTENTIATING EFFECT Kyushu University, National University Corporation (JP) 2024-08-28 EP disclosed
US-20240165016-A1 INTRAVENOUS INFUSION DOSAGE FORM FOR PEMETREXED SUN PHARMACEUTICAL INDUSTRIES LTD (IN) 2024-05-23 US disclosed
US-20240092953-A1 NOVEL COPOLYMER KOWA COMPANY, LTD. (JP) 2024-03-21 US disclosed
CN-117693334-A Pemetrexed disodium liquid composition, preparation method and application thereof 上海云晟研新生物科技有限公司 2024-03-12 CN disclosed
US-20080139810-A1 Processes for the preparation of lyophilized pharmaceutically acceptable salts of pemetrexed diacid ASSIA CHEMICAL INDUSTRIES LTD. (IL) 2008-06-12 US disclosed
WO-2008021411-A2 PROCESSES FOR THE PREPARATION OF LYOPHILIZED PHARMACEUTICALLY ACCEPTABLE SALTS OF PEMETREXED DIACID SICOR INC. (US) 2008-02-21 WO disclosed
US-20060079480-A1 Novel antifolate combination therapies NIYIKIZA CLET 2006-04-13 US disclosed
US-20030212038-A1 Novel antifolate combination therapies ELI LILLY AND COMPANY 2003-11-13 US disclosed
EP-1313508-A2 COMBINATION CONTAINING AN ANTIFOLATE AND METHYLMALONIC ACID LOWERING AGENT ELI LILLY AND COMPANY (US) 2003-05-28 EP disclosed
WO-2002101391-A2 METHOD OF USE ELI LILLY AND COMPANY (US) 2002-12-19 WO disclosed
WO-2002002093-A2 COMBINATION CONTAINING AN ANTIFOLATE AND METHYLMALONIC ACID LOWERING AGENT ELI LILLY AND COMPANY (US) 2002-01-10 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 (5 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-20250002526-A1 PHARMACEUTICAL COMPOSITION HAVING ANTI-CANCER IMMUNOSTIMULATING EFFECT AND/OR IMMUNE CHECKPOINT INHIBITION POTENTIATING EFFECT CD274, PDCD1, PDCD1LG2 GART 3791/4885DHFR 3535/4885TYMS 2625/4885
US-20120329819-A1 NEW CRYSTALLINE FORM OF PEMETREXED DISODIUM TYMP, TYMS, MTHFD1 GART 149/4885DHFR 11/4885TYMS 2/4885
US-20240092953-A1 NOVEL COPOLYMER CX3CR1, CXCR4, SSTR3 GART 4464/4885DHFR 194/4885TYMS 1499/4885
US-20240165016-A1 INTRAVENOUS INFUSION DOSAGE FORM FOR PEMETREXED SLC19A1, FOLR2, SLC29A1 GART 222/4885DHFR 31/4885TYMS 34/4885
US-20080139810-A1 Processes for the preparation of lyophilized pharmaceutically acceptable salts of pemetrexed diacid DCTD, DPYD, PDCD2L GART 77/4885DHFR 19/4885TYMS 7/4885

“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.