SCHEMBL24078876

SCHEMBL24078876

CN(c1nc(Cl)nc2c1ncn2[C@H]1C[C@H](O)[C@@H](COP(=O)(CP(=O)(Oc2ccc(Cl)c(Cl)c2)Oc2ccc(Cl)c(Cl)c2)Oc2ccc(Cl)c(Cl)c2)O1)C1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 9/20 0.54
▸ PNP P00491 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ PDE3A Q14432 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ RXFP1 Q9HBX9 1/20 0.40
▸ POLB P06746 2/20 0.40
▸ ENPP1 P22413 1/20 0.38
▸ P2RY1 P47900 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.37
▸ ADORA2A P29274 1/20 0.37
▸ ADORA1 P30542 1/20 0.37

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
SCHEMBL19100892 0.89 NT5E (0.70) NT5EP2RY1ADORA3ADORA2AADORA1
SCHEMBL30440145 0.89 NT5E (0.70) NT5EP2RY1ADORA3ADORA2AADORA1
SCHEMBL22866387 0.88 NT5E (0.50) NT5EADORA3ADORA2AADORA1
SCHEMBL28740186 0.84 NT5E (0.72) NT5EADORA3ADORA2AADORA1
SCHEMBL19349798 0.80 NT5E (0.69) NT5EADORA3ADORA2AADORA1
SCHEMBL19370293 0.80 NT5E (0.73) NT5EADORA3ADORA2AADORA1
SCHEMBL19370224 0.80 NT5E (0.73) NT5EADORA3ADORA2AADORA1
SCHEMBL24078851 0.79 NT5E (0.49) NT5EADORA3ADORA2AADORA1
SCHEMBL21450327 0.77 NT5E (0.42) NT5E
SCHEMBL19370330 0.77 NT5E (0.42) NT5EP2RY1

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
US-11667662-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ARCUS BIOSCIENCES, INC. (US) 2023-06-06 — — US disclosed
US-20210371449-A1 MODULATORS OF 5'-NUCLEOTIDASE, ECTO AND THE USE THEREOF ARCUS BIOSCIENCES, INC. 2021-12-02 — — 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 (2 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-20210371449-A1 MODULATORS OF 5'-NUCLEOTIDASE, ECTO AND THE USE THEREOF ENTPD5, NT5C2, NT5E NT5E 3/4885PNP 12/4885LMNA 2286/4885
US-11667662-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ENTPD5, NT5C2, NT5E NT5E 3/4885PNP 12/4885LMNA 2274/4885

“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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