SCHEMBL19370283

SCHEMBL19370283

CO[C@H](COP(=O)(O)CP(=O)(O)O)[C@@H](O)[C@@H](O)n1ccc2c(N[C@@H](C)c3ccc(F)cc3)nc(Cl)nc21

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NT5E P21589 18/20 0.59
▸ PDE2A O00408 1/20 0.36
▸ KRAS P01116 1/20 0.34
▸ SOS1 Q07889 1/20 0.34

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
SCHEMBL19370347 0.93 NT5E (0.59) NT5EPDE2AKRASSOS1
SCHEMBL19370286 0.93 NT5E (0.59) NT5EPDE2AKRASSOS1
SCHEMBL19370279 0.91 NT5E (0.62) NT5E
SCHEMBL22843577 0.89 NT5E (0.57) NT5EPDE2A
SCHEMBL19370201 0.88 NT5E (0.60) NT5E
SCHEMBL19370331 0.87 NT5E (0.61) NT5EPDE2A
SCHEMBL19370338 0.87 NT5E (0.61) NT5EPDE2A
SCHEMBL19370232 0.85 NT5E (0.61) NT5E
SCHEMBL19370335 0.85 NT5E (0.61) NT5E
SCHEMBL21450286 0.82 NT5E (0.50) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10239912-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ARCUS BIOSCIENCES, INC. (US) 2019-03-26 — — 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 (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-20170267710-A1 MODULATORS OF 5'-NUCLEOTIDASE, ECTO AND THE USE THEREOF ENTPD5, NT5C2, NT5E NT5E 3/4885PDE2A 137/4885KRAS 2476/4885
US-10239912-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ENTPD5, NT5C2, NT5E NT5E 3/4885PDE2A 142/4885KRAS 2432/4885

“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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