Pemetrexed

Pemetrexed

SCHEMBL577951

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

nearest known ligand 0.75

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 0.75
DHFR known ✓ P00374 6/20 0.75
TYMS known ✓ P04818 5/20 0.75
FOLR1 P15328 4/20 0.75
SLC46A1 Q96NT5 4/20 0.75
ATIC P31939 3/20 0.75
FOLR2 P14207 3/20 0.75
SLC19A1 P41440 3/20 0.75
SHMT1 P34896 2/20 0.75
FRK P42685 1/20 0.75
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 SCHEMBL21600667 1.00 GART (0.75) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL15569564 1.00 GART (0.75) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL16767007 0.99 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL28545416 0.99 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL16767008 0.99 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL1934793 0.99 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL108860 0.99 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL124663 0.99 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL28552890 0.99 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL3760710 0.99 GART (0.76) 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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2992874-B1 LIPOSOME FOR TOPICAL ADMINISTRATION AND APPLICATION THEREOF DELTA FLY PHARMA INC (JP) 2018-08-08 EP claimed
CN-105142613-B Local administrable liposome and application thereof 德尔塔菲制药股份有限公司 2018-03-16 CN claimed
EP-2716304-B1 A LIPOSOME CONTAINING shRNA MOLECULE TARGETING A THYMIDYLATE SYNTHASE AND USE THEREOF DELTA-FLY PHARMA INC (JP) 2017-10-11 EP claimed
US-9745583-B2 Liposome for topical administration and application thereof DELTA-FLY PHARMA, INC. (JP) 2017-08-29 US claimed
CN-103561775-B Comprise liposome of shRNA molecule of anti-thymidylate synthetase and application thereof 德尔塔菲制药股份有限公司 2016-08-17 CN claimed
US-20160208263-A1 LIPOSOME FOR TOPICAL ADMINISTRATION AND APPLICATION THEREOF DELTA-FLY PHARMA, INC. (JP) 2016-07-21 US claimed
EP-2992874-A1 LOCALLY ADMINISTERED LIPOSOME AND APPLICATION THEREFOR Delta-Fly Pharma, Inc. (JP) 2016-03-09 EP claimed
CN-105142613-A Locally administered liposome and application therefor DELTA FLY PHARMA INC 2015-12-09 CN claimed
CN-103561775-A Liposome containing shRNA molecule for thymidylate synthase, and use for same DELTA FLY PHARMA INC 2014-02-05 CN claimed
US-8592572-B2 Liposome containing shRNA molecule targeting a thymidylate synthase and use thereof DELTA-FLY PHARMA, INC. (JP) 2013-11-26 US claimed
US-20130058996-A1 LIPOSOME CONTAINING shRNA MOLECULE TARGETING A THYMIDYLATE SYNTHASE AND USE THEREOF DELTA-FLY PHARMA, INC. (JP) 2013-03-07 US claimed
US-12577307-B2 Method and medicament for treating cancer unresponsive to PD-1/PD-L1 signaling inhibitor GENENTECH, INC. (US) 2026-03-17 US disclosed
US-12486504-B2 Drug delivery composition, method for producing same and use thereof Yamamoto, Hirofumi (JP) 2025-12-02 US disclosed
US-20250288554-A1 PROPHYLACTIC OR THERAPEUTIC AGENT FOR NON-ALCOHOLIC STEATOHEPATITIS-DERIVED HEPATOCARCINOMA SEAKNIT BIOLOGICAL TECHNOLOGY CO., LTD. (CN) 2025-09-18 US disclosed
US-20240360222-A1 ANTIBODY OSAKA UNIVERSITY (JP) 2024-10-31 US disclosed
US-20120045446-A1 THERAPEUTIC AGENT FOR DISEASES IN WHICH NEOPLASTIC PROLIFERATION OF PLASMA CELLS OCCURS OSAKA UNIVERSITY (JP) 2012-02-23 US disclosed
EP-2418222-A1 THERAPEUTIC AGENT FOR DISEASES IN WHICH NEOPLASTIC PROLIFERATION OF PLASMA CELLS OCCURS Osaka University (JP) 2012-02-15 EP disclosed
US-20110319618-A1 HETEROCYCLIC COMPOUND AND USE OF THE SAME NISHIO TETSUYA (JP) 2011-12-29 US disclosed
EP-2253633-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-11-24 EP disclosed
US-20090233937-A1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-17 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 (4 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-20110319618-A1 HETEROCYCLIC COMPOUND AND USE OF THE SAME CYP2D6, CYP2B6, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 GART 1782/4885DHFR 395/4885TYMS 3352/4885
US-12577307-B2 Method and medicament for treating cancer unresponsive to PD-1/PD-L1 signaling inhibitor PDCD1, CD274, PDCD1LG2 GART 3371/4885DHFR 1785/4885TYMS 792/4885
US-20090233937-A1 FUSED HETEROCYCLIC COMPOUND ROS1, JAK2, ERBB2 GART 3627/4885DHFR 1114/4885TYMS 4056/4885
US-20250288554-A1 PROPHYLACTIC OR THERAPEUTIC AGENT FOR NON-ALCOHOLIC STEATOHEPATITIS-DERIVED HEPATOCARCINOMA FABP1, SLC10A1, HDGF GART 2933/4885DHFR 2349/4885TYMS 3910/4885

“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.