SCHEMBL21158533

SCHEMBL21158533

CCOC(=O)[C@H](C)N[P@@](=O)(Cl)Oc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 9/20 0.57
LMNA P02545 1/20 0.45
ANPEP P15144 1/20 0.43
LAP3 P28838 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ELANE P08246 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
MMP8 P22894 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
SCHEMBL23992573 1.00 BTN3A1 (0.57) BTN3A1LMNAANPEPLAP3TDP1
SCHEMBL14466574 1.00 BTN3A1 (0.57) BTN3A1LMNAANPEPLAP3TDP1
SCHEMBL807682 1.00 BTN3A1 (0.57) BTN3A1LMNAANPEPLAP3TDP1
SCHEMBL20117346 0.89 BTN3A1 (0.47) BTN3A1LMNAANPEPLAP3MEN1
SCHEMBL1273013 0.88 BTN3A1 (0.45) BTN3A1LMNATDP1SMN1; SMN2MEN1
SCHEMBL13469571 0.88 BTN3A1 (0.47) BTN3A1ANPEPLAP3MEN1KMT2A
SCHEMBL16015978 0.87 BTN3A1 (0.60) BTN3A1LMNATDP1POLBMEN1
SCHEMBL800889 0.87 BTN3A1 (0.53) BTN3A1ANPEPLAP3MEN1KMT2A
SCHEMBL25387275 0.87 BTN3A1 (0.53) BTN3A1ANPEPLAP3MEN1KMT2A
SCHEMBL23992574 0.87 BTN3A1 (0.53) BTN3A1ANPEPLAP3MEN1KMT2A

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
EP-4209498-A1 4'-THIO-NUCLEOTIDE AND -NUCLEOSIDE PRODRUGS FOR THE TREATMENT OF CANCER Southern Research Institute (US) 2023-07-12 EP disclosed
US-20190185507-A1 Sofosbuvir Derivatives for the Treatment of Hepatitis C SANDOZ AG (CH) 2019-06-20 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-20190185507-A1 Sofosbuvir Derivatives for the Treatment of Hepatitis C HAVCR2, ZC3HAV1, GTF3C4 BTN3A1 2643/4885LMNA 3860/4885ANPEP 257/4885

“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.