SCHEMBL19633812

SCHEMBL19633812

CCCCC[C@H](OC(=O)N[C@@H](CCC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 14/20 0.66
NOD1 Q9Y239 2/20 0.48
NAALAD2 Q9Y3Q0 2/20 0.47
RIMKLA Q8IXN7 1/20 0.47
PLA2G2C Q5R387 1/20 0.41

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
SCHEMBL21162263 0.94 FOLH1 (0.66) FOLH1NOD1NAALAD2RIMKLAPLA2G2C
SCHEMBL22539941 0.86 FOLH1 (0.55) FOLH1NOD1NAALAD2RIMKLAPLA2G2C
SCHEMBL19611476 0.86 FOLH1 (0.64) FOLH1NAALAD2RIMKLA
SCHEMBL19611479 0.86 FOLH1 (0.64) FOLH1NAALAD2RIMKLA
SCHEMBL12349358 0.86 FOLH1 (0.55) FOLH1NOD1NAALAD2RIMKLAPLA2G2C
SCHEMBL19611478 0.86 FOLH1 (0.64) FOLH1NAALAD2RIMKLA
SCHEMBL19633801 0.84 FOLH1 (0.57) FOLH1
Trifluoroacetic Acid SCHEMBL19611495 0.80 FOLH1 (0.57) FOLH1NAALAD2RIMKLA
Trifluoroacetic Acid SCHEMBL19611496 0.80 FOLH1 (0.57) FOLH1NAALAD2RIMKLA
SCHEMBL27098163 0.80 FOLH1 (0.70) FOLH1

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-20170333576-A1 NEW SCAFFOLDS AND MULTIFUNCTIONAL INTERMEDIATES FOR IMAGING PSMA AND CANCER THERAPY THE JOHNS HOPKINS UNIVERSITY (US) 2017-11-23 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-20170333576-A1 NEW SCAFFOLDS AND MULTIFUNCTIONAL INTERMEDIATES FOR IMAGING PSMA AND CANCER THERAPY FOLH1, PSMA3, PSMA7 FOLH1 1/4885NOD1 4238/4885NAALAD2 163/4885

“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.