Pemetrexed

Pemetrexed

SCHEMBL208289

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

nearest known ligand 0.62

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
GART known ✓ P22102 9/20 0.62
DHFR known ✓ P00374 7/20 0.62
TYMS known ✓ P04818 6/20 0.62
FOLR1 P15328 4/20 0.62
SLC46A1 Q96NT5 4/20 0.62
FOLR2 P14207 3/20 0.62
SLC19A1 P41440 3/20 0.62
ATIC P31939 2/20 0.62
SHMT1 P34896 1/20 0.62
FRK P42685 1/20 0.62

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 SCHEMBL4603766 0.99 GART (0.61) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL2190320 0.99 GART (0.61) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL572065 0.89 GART (0.73) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL6034765 0.89 GART (0.77) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL7969 0.89 GART (0.77) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL2549428 0.89 GART (0.77) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL7968 0.89 GART (0.77) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL1934793 0.88 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL15648731 0.88 GART (0.76) GARTDHFRTYMSFOLR1SLC46A1
Pemetrexed SCHEMBL124673 0.88 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 380 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240009198-A1 PEMETREXED FORMULATIONS EAGLE PHARMACEUTICALS, INC. 2024-01-11 US claimed
US-20240009199-A1 PEMETREXED FORMULATIONS EAGLE PHARMACEUTICALS, INC. 2024-01-11 US claimed
US-20230414623-A1 PEMETREXED FORMULATIONS EAGLE PHARMACEUTICALS, INC. 2023-12-28 US claimed
US-20230390295-A1 PEMETREXED FORMULATIONS EAGLE PHARMACEUTICALS, INC. 2023-12-07 US claimed
US-11793813-B2 Pemetrexed formulations EAGLE PHARMACEUTICALS, INC. (US) 2023-10-24 US claimed
US-20230000874-A1 PEMETREXED FORMULATIONS EAGLE PHARMACEUTICALS, INC. (US) 2023-01-05 US claimed
US-20220409623-A1 PEMETREXED FORMULATIONS EAGLE PHARMACEUTICALS, INC. (US) 2022-12-29 US claimed
US-20220409624-A1 PEMETREXED FORMULATIONS EAGLE PHARMACEUTICALS, INC. (US) 2022-12-29 US claimed
CN-115197224-A Novel crystal form of pemetrexed diacid and preparation method thereof 齐鲁制药有限公司 2022-10-18 CN claimed
US-20220151923-A1 STABLE LIQUID COMPOSITIONS OF PEMETREXED FRESENIUS KABI ONCOLOGY LIMITED (IN) 2022-05-19 US claimed
US-20090012294-A1 Highly pure pemetrexed Diacid and processes for the preparation thereof SICOR INC. 2009-01-08 US claimed
WO-2008124485-A2 SOLID FORMS OF PEMETREXED DR. REDDY'S LABORATORIES LTD. (IN) 2008-10-16 WO claimed
EP-1945645-A1 CRYSTALLINE FORMS OF PEMETREXED DIACID AND PROCESSES FOR THE PREPARATION THEREOF Sicor, Inc. (US) 2008-07-23 EP claimed
EP-1943252-A2 PROCESSES FOR THE PREPARATION OF LYOPHILIZED PHARMACEUTICALLY ACCEPTABLE SALTS OF PEMETREXED DIACID Sicor, Inc. (US) 2008-07-16 EP claimed
EP-1934226-A2 HIGHLY PURE PEMETREXED DIACID AND PROCESSES FOR THE PREPARATION THEREOF Sicor, Inc. (US) 2008-06-25 EP claimed
US-20080139810-A1 Processes for the preparation of lyophilized pharmaceutically acceptable salts of pemetrexed diacid ASSIA CHEMICAL INDUSTRIES LTD. (IL) 2008-06-12 US claimed
WO-2008021410-A2 HIGHLY PURE PEMETREXED DIACID AND PROCESSES FOR THE PREPARATION THEREOF SICOR INC. (US) 2008-02-21 WO claimed
WO-2008021405-A1 CRYSTALLINE FORMS OF PEMETREXED DIACID AND PROCESSES FOR THE PREPARATION THEREOF SICOR INC. (US) 2008-02-21 WO claimed
US-20080045711-A1 Crystalline forms of pemetrexed diacid and processes for the preparation thereof ASSIA CHEMICAL INDUSTRIES LTD. (IL) 2008-02-21 US claimed
WO-2008021411-A2 PROCESSES FOR THE PREPARATION OF LYOPHILIZED PHARMACEUTICALLY ACCEPTABLE SALTS OF PEMETREXED DIACID SICOR INC. (US) 2008-02-21 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 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-20240009199-A1 PEMETREXED FORMULATIONS MTHFD1, TYMP, DHFR GART 241/4885DHFR 3/4885TYMS 4/4885
US-20090012294-A1 Highly pure pemetrexed Diacid and processes for the preparation thereof DCTD, DPYD, TYMP GART 38/4885DHFR 6/4885TYMS 4/4885
US-11793813-B2 Pemetrexed formulations MTHFD1, TYMP, DHFR GART 241/4885DHFR 3/4885TYMS 4/4885
US-20240009198-A1 PEMETREXED FORMULATIONS MTHFD1, TYMP, DHFR GART 241/4885DHFR 3/4885TYMS 4/4885
US-20080045711-A1 Crystalline forms of pemetrexed diacid and processes for the preparation thereof DCTD, DPYD, TYMP GART 37/4885DHFR 6/4885TYMS 9/4885
US-20230414623-A1 PEMETREXED FORMULATIONS MTHFD1, TYMP, DHFR GART 241/4885DHFR 3/4885TYMS 4/4885
US-20220409624-A1 PEMETREXED FORMULATIONS MTHFD1, TYMP, DHFR GART 241/4885DHFR 3/4885TYMS 4/4885
US-20220409623-A1 PEMETREXED FORMULATIONS MTHFD1, TYMP, DHFR GART 241/4885DHFR 3/4885TYMS 4/4885
US-20230390295-A1 PEMETREXED FORMULATIONS MTHFD1, TYMP, DHFR GART 241/4885DHFR 3/4885TYMS 4/4885
US-20220151923-A1 STABLE LIQUID COMPOSITIONS OF PEMETREXED H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, DCTD, PDCD5 GART 130/4885DHFR 101/4885TYMS 20/4885
US-20230000874-A1 PEMETREXED FORMULATIONS MTHFD1, TYMP, DHFR GART 241/4885DHFR 3/4885TYMS 4/4885
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.