SCHEMBL16587346

SCHEMBL16587346

CCCCOC[P@@](=O)(N[C@@H](C)C(=O)OCCC)Oc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 8/20 0.49
TSHR P16473 1/20 0.43
RECQL P46063 1/20 0.43
LMNA P02545 1/20 0.39
HDAC3 O15379 1/20 0.39
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
PRTN3 P24158 1/20 0.38

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
SCHEMBL16587348 1.00 BTN3A1 (0.49) BTN3A1TSHRRECQLLMNAHDAC3
SCHEMBL16587345 1.00 BTN3A1 (0.49) BTN3A1TSHRRECQLLMNAHDAC3
SCHEMBL18801715 0.93 BTN3A1 (0.57) BTN3A1TSHRRECQLLMNAHDAC3
SCHEMBL16587339 0.93 BTN3A1 (0.57) BTN3A1TSHRRECQLLMNAHDAC3
SCHEMBL18802032 0.93 BTN3A1 (0.57) BTN3A1TSHRRECQLLMNAHDAC3
SCHEMBL16587330 0.93 BTN3A1 (0.57) BTN3A1TSHRRECQLLMNAHDAC3
SCHEMBL16587316 0.93 BTN3A1 (0.57) BTN3A1TSHRRECQLLMNAHDAC3
SCHEMBL16587329 0.93 BTN3A1 (0.57) BTN3A1TSHRRECQLLMNAHDAC3
SCHEMBL19189363 0.88 BTN3A1 (0.48) BTN3A1LMNAPRTN3
SCHEMBL16587342 0.86 BTN3A1 (0.57) BTN3A1LMNAMAPTPRTN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9783567-B2 Processes and intermediates for preparing anti-HIV agents GILEAD SCIENCES, INC. (US) 2017-10-10 US disclosed
US-20160340379-A1 PROCESSES AND INTERMEDIATES FOR PREPARING ANTI-HIV AGENTS GILEAD SCIENCES, INC. 2016-11-24 US disclosed
US-8987437-B2 Processes and intermediates for preparing anti-HIV Agents GILEAD SCIENCES, INC. (US) 2015-03-24 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-20160340379-A1 PROCESSES AND INTERMEDIATES FOR PREPARING ANTI-HIV AGENTS SAMHD1, DHPS, LSS BTN3A1 4464/4885TSHR 4779/4885RECQL 1871/4885

“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.