SCHEMBL22288955

SCHEMBL22288955

O=C(O)c1cc([C@@H]2O[C@H](COCc3ccccc3)[C@@H](OCc3ccccc3)[C@H]2OCc2ccccc2)sn1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 9/20 0.45
▸ CDC25B P30305 7/20 0.45
▸ PTPN2 P17706 6/20 0.45
▸ PTPN11 Q06124 5/20 0.45
▸ PTPN6 P29350 4/20 0.45
▸ TACR2 P21452 3/20 0.45
▸ NT5E P21589 1/20 0.45
▸ HTR1A P08908 1/20 0.43
▸ TP53 P04637 1/20 0.40
▸ MDM2 Q00987 1/20 0.40
▸ BCHE P06276 1/20 0.39
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 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
SCHEMBL30646410 0.87 TACR2 (0.45) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL22288944 0.78 CA1 (0.40) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL26658237 0.77 TACR2 (0.44) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL26658233 0.75 TACR2 (0.44) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL26658247 0.75 TACR2 (0.44) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL24146782 0.75 NT5E (0.49) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL5521002 0.74 NT5E (0.48) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL22288951 0.73 NT5E (0.46) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL3898371 0.73 NT5E (0.54) PTPN1CDC25BPTPN2PTPN11PTPN6
SCHEMBL3898367 0.73 NT5E (0.54) PTPN1CDC25BPTPN2PTPN11PTPN6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230365608-A1 ANTIVIRAL NUCLEOSIDES AND DERIVATIVES THEREOF JANSSEN BIOPHARMA, LLC 2023-11-16 — — US disclosed
EP-3917922-A1 ANTIVIRAL NUCLEOSIDES AND DERIVATIVES THEREOF Janssen BioPharma, Inc. (US) 2021-12-08 — — EP disclosed
WO-2020157694-A9 ANTIVIRAL NUCLEOSIDES AND DERIVATIVES THEREOF Janssen Biopharma, Inc. (US) 2021-11-11 — — WO disclosed
WO-2020157694-A1 ANTIVIRAL NUCLEOSIDES AND DERIVATIVES THEREOF Janssen Biopharma, Inc. (US) 2020-08-06 — — 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-20230365608-A1 ANTIVIRAL NUCLEOSIDES AND DERIVATIVES THEREOF PNP, NUDT1, ADAR PTPN1 1323/4885CDC25B 1748/4885PTPN2 1653/4885

“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.

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