SCHEMBL29322963

SCHEMBL29322963

CC(C)(C)C(=O)OCOP(=O)(CC(Br)Br)OCOC(=O)C(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 8/20 0.51
ALDH1A1 P00352 1/20 0.43
ENO1 P06733 2/20 0.40
PRKCA P17252 1/20 0.37
ABCB11 O95342 1/20 0.36
POLA1 P09884 1/20 0.36
POLG P54098 1/20 0.36
FAP Q12884 1/20 0.36
SLC22A6 Q4U2R8 1/20 0.36
FNTA P49354 1/20 0.33
FNTB P49356 1/20 0.33

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
SCHEMBL2458617 0.82 BTN3A1 (0.60) BTN3A1ALDH1A1ENO1PRKCAABCB11
SCHEMBL9891073 0.81 BTN3A1 (0.54) BTN3A1ALDH1A1ENO1PRKCAABCB11
SCHEMBL27602723 0.81 BTN3A1 (0.54) BTN3A1ALDH1A1ENO1PRKCAABCB11
SCHEMBL9891072 0.81 BTN3A1 (0.58) BTN3A1ALDH1A1ENO1PRKCAABCB11
SCHEMBL17039630 0.79 BTN3A1 (0.53) BTN3A1ALDH1A1ENO1PRKCAABCB11
SCHEMBL10378800 0.78 BTN3A1 (0.50) BTN3A1ALDH1A1ENO1PRKCAABCB11
SCHEMBL17533526 0.77 FOLH1 (0.47) BTN3A1
SCHEMBL17036739 0.76 BTN3A1 (0.50) BTN3A1ALDH1A1ENO1PRKCAABCB11
SCHEMBL10251138 0.76 BTN3A1 (0.57) BTN3A1ALDH1A1ENO1PRKCAABCB11
SCHEMBL3437081 0.76 BTN3A1 (0.53) BTN3A1ALDH1A1ENO1PRKCAABCB11

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-20240239821-A1 N-ACYL FOSMIDOMYCIN PRODRUG ANALOGS AS NOVEL ANTIINFECTIVE AGENTS THE GEORGE WASHINGTON UNIVERSITY 2024-07-18 US disclosed
US-20240239821-A1 N-ACYL FOSMIDOMYCIN PRODRUG ANALOGS AS NOVEL ANTIINFECTIVE AGENTS THE GEORGE WASHINGTON UNIVERSITY 2024-07-18 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-20240239821-A1 N-ACYL FOSMIDOMYCIN PRODRUG ANALOGS AS NOVEL ANTIINFECTIVE AGENTS PSPH, PGLS, DNPEP BTN3A1 4476/4885ALDH1A1 3707/4885ENO1 99/4885

“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.