SCHEMBL97583

SCHEMBL97583

O=CNC(CCC(=O)O)C(=O)NC(CCC(=O)O)C(=O)NCCCC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 4/20 0.40
▸ RIMKLA Q8IXN7 1/20 0.39
▸ NAALAD2 Q9Y3Q0 1/20 0.39
▸ CCKBR P32239 1/20 0.38
▸ SIRT5 Q9NXA8 1/20 0.38
▸ BMP1 P13497 2/20 0.38
▸ EPHX2 P34913 1/20 0.37

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
SCHEMBL97580 0.86 GLO1 (0.40) FOLH1RIMKLANAALAD2CCKBRBMP1
SCHEMBL27265533 0.79 PRMT1 (0.45) EPHX2
SCHEMBL173098 0.79 FOLH1 (0.40) FOLH1RIMKLANAALAD2
SCHEMBL27571433 0.78 PTGS1 (0.51) FOLH1RIMKLANAALAD2BMP1
SCHEMBL27265592 0.78 SIRT6 (0.45) FOLH1EPHX2
SCHEMBL27571430 0.78 PTGS1 (0.51) FOLH1RIMKLANAALAD2BMP1
SCHEMBL9800723 0.78 FOLH1 (0.49) FOLH1RIMKLANAALAD2
SCHEMBL9800724 0.78 FOLH1 (0.49) FOLH1RIMKLANAALAD2
SCHEMBL27265483 0.77 PRMT1 (0.49) EPHX2
SCHEMBL22648340 0.77 BMP1 (0.39) FOLH1RIMKLANAALAD2SIRT5BMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120058932-A1 ACTIVE INGREDIENT-PEPTIDE CONSTRUCT FOR EXTRACELLULAR CONCENTRATION MAX PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2012-03-08 — — US disclosed
US-20120058932-A1 ACTIVE INGREDIENT-PEPTIDE CONSTRUCT FOR EXTRACELLULAR CONCENTRATION MAX PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2012-03-08 — — 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-20120058932-A1 ACTIVE INGREDIENT-PEPTIDE CONSTRUCT FOR EXTRACELLULAR CONCENTRATION VIP, FIBP, MMP7 FOLH1 198/4885RIMKLA 2508/4885NAALAD2 1243/4885

“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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