SCHEMBL7458713

SCHEMBL7458713

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

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 12/20 0.42
NAALAD2 Q9Y3Q0 2/20 0.42
RIMKLA Q8IXN7 1/20 0.42
GGH Q92820 2/20 0.41
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL29105485 0.84 MEN1 (0.37) MEN1GAAKMT2A
SCHEMBL6921214 0.80 CTSL (0.43) FOLH1MEN1GAAKMT2A
SCHEMBL4416791 0.80 CTSL (0.43) FOLH1MEN1GAAKMT2A
SCHEMBL1564466 0.79 FOLH1 (0.40) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL29274486 0.79 MEN1 (0.36) MEN1GAAKMT2A
SCHEMBL1248320 0.78 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGGH
SCHEMBL9696087 0.78 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGGH
SCHEMBL5575587 0.78 FOLH1 (0.55) FOLH1NAALAD2RIMKLAGGH
SCHEMBL626934 0.78 FOLH1 (0.44) FOLH1NAALAD2RIMKLAGGHMEN1
SCHEMBL626933 0.78 FOLH1 (0.44) FOLH1NAALAD2RIMKLAGGHMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6472541-B2 HALOGENATED- COUMARIN, QUINOLINE-2-ONE, XANTHENE, THIOXANTHENE, SELENOXANTHENEN, OR ANTHRACENE DERIVATIVES; IRRADIATING TO CONTROL THE RELEASE OF THE SOMPOUND SPATIALLY AND TEMPORALLY TO PROBE ITS BIOLOGICAL EFFECTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2002-10-29 US disclosed
EP-1151350-A4 PROTECTING GROUPS WITH INCREASED PHOTOSENSITIVITIES UNIV CALIFORNIA (US) 2002-08-21 EP disclosed
US-20020016472-A1 PROTECTING GROUPS WITH INCREASED PHOTOSENSITIVITIES REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2002-02-07 US disclosed
EP-1151350-A1 PROTECTING GROUPS WITH INCREASED PHOTOSENSITIVITIES The Regents of the University of California (US) 2001-11-07 EP disclosed
WO-2000031588-A1 PROTECTING GROUPS WITH INCREASED PHOTOSENSITIVITIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2000-06-02 WO 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-20020016472-A1 PROTECTING GROUPS WITH INCREASED PHOTOSENSITIVITIES ERCC4, XPA, GPX4 FOLH1 2487/4885NAALAD2 2551/4885RIMKLA 4709/4885

“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.