SCHEMBL22387175

SCHEMBL22387175

C[C@H](N)C(=O)OC[C@H]1O[C@@H](n2ccc(NO)nc2=O)[C@H](O)[C@@H]1O

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY6 Q15077 8/20 0.54
P2RY2 P41231 5/20 0.54
P2RY4 P51582 5/20 0.54
LMNA P02545 1/20 0.48
THRB P10828 1/20 0.48
MTOR P42345 1/20 0.48
MDM2 Q00987 1/20 0.48
NCOA1 Q15788 1/20 0.48
NCOA3 Q9Y6Q9 1/20 0.48
P2RY14 Q15391 2/20 0.48
NT5E P21589 1/20 0.48

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
SCHEMBL22387095 1.00 P2RY6 (0.54) P2RY6P2RY2P2RY4LMNATHRB
SCHEMBL22387158 0.92 P2RY6 (0.55) P2RY6P2RY2P2RY4LMNATHRB
SCHEMBL22387092 0.92 P2RY6 (0.52) P2RY6P2RY2P2RY4LMNATHRB
SCHEMBL22387192 0.92 P2RY6 (0.55) P2RY6P2RY2P2RY4LMNATHRB
SCHEMBL21345106 0.92 P2RY6 (0.52) P2RY6P2RY2P2RY4LMNATHRB
SCHEMBL23762552 0.92 P2RY6 (0.52) P2RY6P2RY2P2RY4LMNATHRB
Molnupiravir SCHEMBL24628124 0.92 P2RY6 (0.56) P2RY6P2RY2P2RY4LMNATHRB
Molnupiravir SCHEMBL21345150 0.92 P2RY6 (0.56) P2RY6P2RY2P2RY4LMNATHRB
Molnupiravir SCHEMBL25255890 0.92 P2RY6 (0.56) P2RY6P2RY2P2RY4LMNATHRB
Molnupiravir SCHEMBL25922035 0.92 P2RY6 (0.56) P2RY6P2RY2P2RY4LMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230190782-A1 NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF ASCLETIS BIOSCIENCE CO., LTD. (CN) 2023-06-22 US disclosed
US-20230190782-A1 NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF ASCLETIS BIOSCIENCE CO., LTD. (CN) 2023-06-22 US disclosed
US-11541071-B1 Nucleoside derivatives and methods of use thereof Ascletis BioScience Co., Ltd (CN) 2023-01-03 US disclosed
US-11331331-B2 N4-hydroxycytidine and derivatives and anti-viral uses related thereto EMORY UNIVERSITY (US) 2022-05-17 US disclosed
US-20220016153-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-01-20 US disclosed
US-11197882-B2 2021-12-14 US disclosed
US-11147826-B2 2021-10-19 US disclosed
US-20210252033-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-08-19 US disclosed
US-20200276219-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-09-03 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 (8 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-11331331-B2 N4-hydroxycytidine and derivatives and anti-viral uses related thereto ENTPD1, NME2, NME1 P2RY6 380/4885P2RY2 843/4885P2RY4 232/4885
US-11147826-B2 SNRPE, NME2, NME1 P2RY6 398/4885P2RY2 508/4885P2RY4 317/4885
US-20220016153-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO ENTPD1, NME2, NME1 P2RY6 380/4885P2RY2 843/4885P2RY4 232/4885
US-20230190782-A1 NUCLEOSIDE DERIVATIVES AND METHODS OF USE THEREOF TYMP, NUDT1, PNP P2RY6 731/4885P2RY2 1449/4885P2RY4 657/4885
US-20210252033-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO TYMP, MTAP, DCTD P2RY6 694/4885P2RY2 1502/4885P2RY4 608/4885
US-11541071-B1 Nucleoside derivatives and methods of use thereof TYMP, NUDT1, PNP P2RY6 731/4885P2RY2 1449/4885P2RY4 657/4885
US-20200276219-A1 N4-HYDROXYCYTIDINE AND DERIVATIVES AND ANTI-VIRAL USES RELATED THERETO ENTPD1, NME2, NME1 P2RY6 380/4885P2RY2 843/4885P2RY4 232/4885
US-11197882-B2 SNRPE, NME2, NME1 P2RY6 398/4885P2RY2 508/4885P2RY4 317/4885

“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.