SCHEMBL14870980

SCHEMBL14870980

CC(C)(C)C(=O)Oc1ccc(CI)cc1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 18/20 0.73
PRTN3 P24158 3/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL3657615 0.87 ELANE (0.76) ELANEPRTN3MEN1KMT2A
SCHEMBL10483720 0.85 ELANE (1.00) ELANEPRTN3KMT2A
SCHEMBL22369614 0.84 ELANE (0.86) ELANEPRTN3
SCHEMBL16189796 0.83 ELANE (0.76) ELANEPRTN3
SCHEMBL3657617 0.83 ELANE (0.76) ELANEPRTN3
SCHEMBL7276499 0.81 ELANE (0.73) ELANEPRTN3
SCHEMBL10973406 0.81 ELANE (0.73) ELANEPRTN3
SCHEMBL9299504 0.81 ELANE (0.73) ELANEPRTN3
SCHEMBL23896984 0.80 ELANE (0.71) ELANEPRTN3
SCHEMBL4888012 0.80 ELANE (0.71) ELANE

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-20130096092-A1 THIOETHER PRODRUG COMPOSITIONS AS ANTI-HIV AND ANTI-RETROVIRAL AGENTS HEALTH AND HUMAN SERVICES (US) 2013-04-18 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-20130096092-A1 THIOETHER PRODRUG COMPOSITIONS AS ANTI-HIV AND ANTI-RETROVIRAL AGENTS SLC30A7, SLC30A6, SLC39A7 ELANE 1818/4885PRTN3 78/4885MEN1 4438/4885

“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.