SCHEMBL1065450

SCHEMBL1065450

Nc1nc(=O)c2c([nH]1)NCC(CCc1ccc(C(=O)N[C@H](CCC(=O)O)C(=O)O)s1)C2

nearest known ligand 0.62

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GART P22102 13/20 0.62
FOLR1 P15328 11/20 0.56
SLC46A1 Q96NT5 8/20 0.56
SLC19A1 P41440 5/20 0.56
FOLR2 P14207 4/20 0.56
ATIC P31939 5/20 0.55
SHMT1 P34896 3/20 0.52
SHMT2 P34897 3/20 0.52

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
SCHEMBL1065440 1.00 GART (0.62) GARTFOLR1SLC46A1SLC19A1FOLR2
SCHEMBL6829597 1.00 GART (0.62) GARTFOLR1SLC46A1SLC19A1FOLR2
SCHEMBL20659947 1.00 GART (0.62) GARTFOLR1SLC46A1SLC19A1FOLR2
SCHEMBL27529613 1.00 GART (0.62) GARTFOLR1SLC46A1SLC19A1FOLR2
SCHEMBL7745908 0.88 GART (0.75) GARTFOLR1SLC46A1SLC19A1FOLR2
Lometrexol SCHEMBL18530 0.85 GART (0.78) GARTFOLR1SLC46A1SLC19A1FOLR2
Lometrexol SCHEMBL21248426 0.85 GART (0.77) GARTFOLR1SLC46A1SLC19A1FOLR2
SCHEMBL9380609 0.82 DHFR (0.59) GARTFOLR1SLC46A1SLC19A1FOLR2
SCHEMBL9383067 0.82 DHFR (0.59) GARTFOLR1SLC46A1SLC19A1FOLR2
SCHEMBL9381796 0.82 DHFR (0.59) GARTFOLR1SLC46A1SLC19A1FOLR2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020103212-A1 Pharmaceutical compositions containing anti-fas antibody SANKYO COMPANY, LIMITED (JP) 2002-08-01 US claimed
US-7981421-B2 Combinations of antibodies selective for DR5 and other therapeutic agents THE UAB RESEARCH FOUNDATION (US) 2011-07-19 US disclosed
US-20110002887-A1 COMBINATIONS OF ANTIBODIES SELECTIVE FOR DR5 AND OTHER THERAPEUTIC AGENTS THE UAB RESEARCH FOUNDATION (US) 2011-01-06 US disclosed
US-7704502-B2 Combinations of antibodies selective for DR5 and other therapeutic agents THE UAB RESEARCH FOUNDATION (US) 2010-04-27 US disclosed
US-20090022707-A1 Combinations of Antibodies Selective for a Tumor Necrosis Factor-Related Apoptosis-Inducing Ligand Receptor and Other Therapeutic Agents THE UAB RESEARCH FOUNDATION (US) 2009-01-22 US disclosed
US-7279160-B2 Combinations of DR5 antibodies and other therapeutic agents THE UAB RESEARCH FOUNDATION (US) 2007-10-09 US disclosed
US-6746673-B2 FOR PROPHYLAXIS AND/OR TREATMENT OF AN AUTOIMMUNE DISEASE OR RHEUMATOID ARTHRITIS SANKYO COMPANY, LIMITED (JP) 2004-06-08 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-20020103212-A1 Pharmaceutical compositions containing anti-fas antibody DHFR, FOLR1, FOLR2 GART 243/4885FOLR1 2/4885SLC46A1 64/4885

“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.