SCHEMBL15947420

SCHEMBL15947420

Cc1ccc(CC(CC(N)C(=O)O)C(=O)O)cc1F

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC1A1 P43005 4/20 0.57
▸ SLC1A3 P43003 4/20 0.57
▸ SLC1A2 P43004 4/20 0.57
▸ GRM2 Q14416 1/20 0.43
▸ GRM3 Q14832 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ EGFR P00533 1/20 0.43
▸ LCK P06239 1/20 0.43
▸ FYN P06241 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ HTR2A P28223 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ SLC7A5 Q01650 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL13623320 0.89 SLC1A1 (0.57) SLC1A1SLC1A3SLC1A2GRM2GRM3
SCHEMBL2777585 0.87 SLC7A5 (0.57) KDM4EUSP2EGFRLCKFYN
SCHEMBL2777583 0.87 SLC7A5 (0.57) KDM4EUSP2EGFRLCKFYN
SCHEMBL31734664 0.87 SLC7A5 (0.57) KDM4EUSP2EGFRLCKFYN
SCHEMBL6774498 0.87 SLC7A5 (0.57) KDM4EUSP2EGFRLCKFYN
Hydrochloric Acid SCHEMBL6770667 0.85 SLC7A5 (0.55) KDM4EUSP2EGFRLCKFYN
Hydrochloric Acid SCHEMBL6770660 0.85 SLC7A5 (0.55) KDM4EUSP2EGFRLCKFYN
Hydrochloric Acid SCHEMBL5367785 0.85 SLC7A5 (0.55) KDM4EUSP2EGFRLCKFYN
SCHEMBL13464177 0.84 SLC1A1 (0.59) SLC1A1SLC1A3SLC1A2GRM2GRM3
SCHEMBL12656312 0.82 SLC1A1 (0.59) SLC1A1SLC1A3SLC1A2GRM2GRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140227191-A1 L-GLUTAMIC ACID AND L-GLUTAMINE DERIVATIVE (III), USE THEREOF AND METHOD FOR OBTAINING THEM BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2014-08-14 — — 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-20140227191-A1 L-GLUTAMIC ACID AND L-GLUTAMINE DERIVATIVE (III), USE THEREOF AND METHOD FOR OBTAINING THEM GLUL, GATD3, QPCT SLC1A1 6/4885SLC1A3 5/4885SLC1A2 8/4885

“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.

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