SCHEMBL19366702

SCHEMBL19366702

OC[C@H]1O[C@@H](n2ncc3c(NC4CCCC4)nc(Cl)nc32)[C@H](O)[C@@H]1O

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NT5E P21589 17/20 0.73
ADORA3 P0DMS8 1/20 0.65
ADORA2A P29274 1/20 0.65
ADORA2B P29275 1/20 0.65
ADORA1 P30542 1/20 0.65
MEN1 O00255 1/20 0.65
CYP1A2 P05177 1/20 0.65
MAPK1 P28482 1/20 0.65
KMT2A Q03164 1/20 0.65

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
SCHEMBL23915097 1.00 NT5E (0.73) NT5EADORA3ADORA2AADORA2BADORA1
SCHEMBL24618960 0.98 NT5E (0.70) NT5E
SCHEMBL19366711 0.91 NT5E (0.71) NT5EADORA3ADORA2AADORA2BADORA1
SCHEMBL24619126 0.88 NT5E (0.59) NT5E
SCHEMBL24618924 0.88 NT5E (0.58) NT5E
SCHEMBL30008238 0.87 NT5E (0.59) NT5E
SCHEMBL24619067 0.86 NT5E (0.56) NT5EADORA2A
SCHEMBL20168539 0.85 NT5E (0.64) NT5E
SCHEMBL27210210 0.85 NT5E (0.73) NT5E
SCHEMBL22614572 0.84 NT5E (1.00) NT5E

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024010810-A2 FC CONJUGATES INCLUDING AN INHIBITOR OF CD73 AND USES THEREOF CIDARA THERAPEUTICS, INC. (US) 2024-01-11 WO disclosed
US-11807658-B2 CD73 inhibitors ORIC PHARMACEUTICALS, INC. (US) 2023-11-07 US disclosed
US-11667662-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ARCUS BIOSCIENCES, INC. (US) 2023-06-06 US disclosed
US-11667662-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ARCUS BIOSCIENCES, INC. (US) 2023-06-06 US disclosed
US-11591355-B2 CD73 inhibitors and uses thereof PELOTON THERAPEUTICS INC. (US) 2023-02-28 US disclosed
US-20220220147-A1 CD73 INHIBITORS ORIC PHARMACEUTICALS, INC. 2022-07-14 US disclosed
US-11325938-B2 CD73 inhibitors ORIC PHARMACEUTICALS, INC. (US) 2022-05-10 US disclosed
US-11267845-B2 Inhibitors of CD73-mediated immunosuppression ARCUS BIOSCIENCES, INC. (US) 2022-03-08 US disclosed
US-20210371449-A1 MODULATORS OF 5'-NUCLEOTIDASE, ECTO AND THE USE THEREOF ARCUS BIOSCIENCES, INC. 2021-12-02 US disclosed
US-20210317150-A1 CD73 INHIBITORS AND USES THEREOF PELOTON THERAPEUTICS, INC. (US) 2021-10-14 US disclosed
US-20200222441-A1 INHIBITORS OF ADENOSINE 5'-NUCLEOTIDASE ARCUS BIOSCIENCES, INC. 2020-07-16 US disclosed
US-20200115404-A1 CD73 INHIBITORS AND USES THEREOF PELOTON THERAPEUTICS INC. 2020-04-16 US disclosed
US-20200115404-A1 CD73 INHIBITORS AND USES THEREOF PELOTON THERAPEUTICS INC. 2020-04-16 US disclosed
US-20200062797-A1 INHIBITORS OF CD73-MEDIATED IMMUNOSUPPRESSION ARCUS BIOSCIENCES, INC. 2020-02-27 US disclosed
EP-3600273-A1 CD73 INHIBITORS AND USES THEREOF Peloton Therapeutics, Inc. (US) 2020-02-05 EP disclosed
US-10239912-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ARCUS BIOSCIENCES, INC. (US) 2019-03-26 US disclosed
WO-2018183635-A1 CD73 INHIBITORS AND USES THEREOF PELOTON THERAPEUTICS, INC. (US) 2018-10-04 WO disclosed
WO-2018094148-A1 INHIBITORS OF CD73-MEDIATED IMMUNOSUPPRESSION ARCUS BIOSCIENCES, INC. (US) 2018-05-24 WO disclosed
US-20170267710-A1 MODULATORS OF 5'-NUCLEOTIDASE, ECTO AND THE USE THEREOF ARCUS BIOSCIENCES, INC. 2017-09-21 US disclosed
US-20170267710-A1 MODULATORS OF 5'-NUCLEOTIDASE, ECTO AND THE USE THEREOF ARCUS BIOSCIENCES, INC. 2017-09-21 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 (13 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-20200115404-A1 CD73 INHIBITORS AND USES THEREOF ENTPD5, ENTPD1, NT5E NT5E 3/4885ADORA3 29/4885ADORA2A 11/4885
US-11807658-B2 CD73 inhibitors ENTPD5, NT5E, ENTPD1 NT5E 2/4885ADORA3 19/4885ADORA2A 11/4885
US-20220220147-A1 CD73 INHIBITORS ENTPD5, NT5E, ENTPD1 NT5E 2/4885ADORA3 19/4885ADORA2A 11/4885
US-11325938-B2 CD73 inhibitors ENTPD5, NT5E, ENTPD1 NT5E 2/4885ADORA3 19/4885ADORA2A 11/4885
US-20170267710-A1 MODULATORS OF 5'-NUCLEOTIDASE, ECTO AND THE USE THEREOF ENTPD5, NT5C2, NT5E NT5E 3/4885ADORA3 35/4885ADORA2A 19/4885
US-20210371449-A1 MODULATORS OF 5'-NUCLEOTIDASE, ECTO AND THE USE THEREOF ENTPD5, NT5C2, NT5E NT5E 3/4885ADORA3 35/4885ADORA2A 19/4885
US-20200222441-A1 INHIBITORS OF ADENOSINE 5'-NUCLEOTIDASE ENTPD5, NT5C2, ENTPD1 NT5E 4/4885ADORA3 34/4885ADORA2A 19/4885
US-11591355-B2 CD73 inhibitors and uses thereof ENTPD5, ENTPD1, ENTPD3 NT5E 5/4885ADORA3 9/4885ADORA2A 8/4885
US-11667662-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ENTPD5, NT5C2, NT5E NT5E 3/4885ADORA3 37/4885ADORA2A 19/4885
US-10239912-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ENTPD5, NT5C2, NT5E NT5E 3/4885ADORA3 37/4885ADORA2A 19/4885
US-20200062797-A1 INHIBITORS OF CD73-MEDIATED IMMUNOSUPPRESSION ENTPD5, NT5E, ENTPD1 NT5E 2/4885ADORA3 28/4885ADORA2A 13/4885
US-11267845-B2 Inhibitors of CD73-mediated immunosuppression ENTPD5, NT5E, ENTPD1 NT5E 2/4885ADORA3 28/4885ADORA2A 13/4885
US-20210317150-A1 CD73 INHIBITORS AND USES THEREOF ENTPD5, ENTPD1, NT5E NT5E 3/4885ADORA3 29/4885ADORA2A 11/4885

“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.