SCHEMBL21291966

SCHEMBL21291966

CCOC(=O)OC[C@H]1O[C@@H](n2cnc3c(N)nc(Cl)nc32)[C@@H](F)[C@@H]1OC(=O)OC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NT5E P21589 17/20 0.59
CD99 P14209 1/20 0.53
ADORA3 P0DMS8 2/20 0.52
PDE2A O00408 2/20 0.52
ADORA2A P29274 1/20 0.52
ADORA1 P30542 1/20 0.52
ADRA1A P35348 1/20 0.52
PDE4D Q08499 1/20 0.52
PDE3A Q14432 1/20 0.52

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
SCHEMBL21802814 0.92 NT5E (0.52) NT5ECD99ADORA3PDE2AADORA2A
SCHEMBL30198810 0.92 NT5E (0.52) NT5ECD99ADORA3PDE2AADORA2A
SCHEMBL21291974 0.92 NT5E (0.52) NT5ECD99ADORA3PDE2AADORA2A
SCHEMBL21291984 0.92 NT5E (0.54) NT5ECD99ADORA3PDE2AADORA2A
SCHEMBL30198570 0.91 NT5E (0.51) NT5ECD99ADORA3PDE2AADORA2A
SCHEMBL21291967 0.91 NT5E (0.51) NT5ECD99ADORA3PDE2AADORA2A
SCHEMBL21291979 0.91 NT5E (0.51) NT5ECD99ADORA3PDE2AADORA2A
SCHEMBL23743770 0.90 PDE2A (0.64) NT5EPDE2A
SCHEMBL21291968 0.89 PDE2A (0.64) NT5ECD99ADORA3PDE2AADORA2A
SCHEMBL21291988 0.87 NT5E (0.53) NT5ECD99ADORA3PDE2AADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11701377-B2 Methods for treating cancers by prodrugs of clofarabine BoYen Therapeutics, Inc. (TW) 2023-07-18 US disclosed
US-11701377-B2 Methods for treating cancers by prodrugs of clofarabine BoYen Therapeutics, Inc. (TW) 2023-07-18 US disclosed
US-11701377-B2 Methods for treating cancers by prodrugs of clofarabine BoYen Therapeutics, Inc. (TW) 2023-07-18 US disclosed
EP-3529254-B1 PRODRUGS OF CLOFARABINE WU LAURENCE I (TW) 2023-02-22 EP disclosed
US-20210244755-A1 METHODS FOR TREATING CANCERS BY PRODRUGS OF CLOFARABINE BoYen Therapeutics, Inc. (TW) 2021-08-12 US disclosed
US-20210244755-A1 METHODS FOR TREATING CANCERS BY PRODRUGS OF CLOFARABINE BoYen Therapeutics, Inc. (TW) 2021-08-12 US disclosed
US-11021510-B2 Prodrugs of clofarabine BoYen Therapeutics, Inc. (TW) 2021-06-01 US disclosed
US-11021510-B2 Prodrugs of clofarabine BoYen Therapeutics, Inc. (TW) 2021-06-01 US disclosed
US-20200095272-A1 PRODRUGS OF CLOFARABINE BoYen Therapeutics, Inc. (TW) 2020-03-26 US disclosed
US-20200095272-A1 PRODRUGS OF CLOFARABINE BoYen Therapeutics, Inc. (TW) 2020-03-26 US disclosed
EP-3529254-A1 PRODRUGS OF CLOFARABINE Wu, Laurence I. (TW) 2019-08-28 EP 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 (4 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-20200095272-A1 PRODRUGS OF CLOFARABINE CXCR2, FOLR1, ALK NT5E 385/4885CD99 2594/4885ADORA3 298/4885
US-11701377-B2 Methods for treating cancers by prodrugs of clofarabine FOLR1, DHFR, CBR1 NT5E 2242/4885CD99 1871/4885ADORA3 1292/4885
US-11021510-B2 Prodrugs of clofarabine ALK, BCL6, DHFR NT5E 2379/4885CD99 1663/4885ADORA3 1303/4885
US-20210244755-A1 METHODS FOR TREATING CANCERS BY PRODRUGS OF CLOFARABINE DHFR, FOLR1, ALK NT5E 2312/4885CD99 1847/4885ADORA3 1329/4885

“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.