SCHEMBL24078872

SCHEMBL24078872

CO[C@H](COP(=O)(O)CP(=O)(O)O)[C@@H](O)Cn1cnc2c(NCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)ncnc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 2/20 0.42
▸ CDK2 P24941 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ MAPK8 P45983 1/20 0.41
▸ CSNK1A1 P48729 1/20 0.41
▸ CSNK1D P48730 1/20 0.41
▸ CDK7 P50613 1/20 0.41
▸ CCNH P51946 1/20 0.41
▸ MNAT1 P51948 1/20 0.41
▸ NT5E P21589 5/20 0.41
▸ CDK1 P06493 2/20 0.41
▸ ENPP1 P22413 1/20 0.36
▸ RAB9A P51151 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ AURKA O14965 1/20 0.35
▸ RPS6KB1 P23443 1/20 0.35
▸ TMIGD3 P0DMS9 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ ABL1 P00519 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
SCHEMBL19370202 0.86 CDK2 (0.47) CDK2MAPK1MAPK8CSNK1A1CSNK1D
SCHEMBL19370337 0.79 CDK2 (0.45) CDK2MAPK1MAPK8CSNK1A1CSNK1D
SCHEMBL22843534 0.77 CDK2 (0.48) CDK2MAPK1MAPK8CSNK1A1CSNK1D
SCHEMBL24078847 0.75 NT5E (0.57) P2RY1NT5ECDK1
SCHEMBL19100823 0.73 NT5E (0.76) NT5EENPP1
SCHEMBL21450235 0.72 NT5E (0.54) CDK2NT5ECDK1RAB9AKMT2A
SCHEMBL19370287 0.72 CCNB2 (0.47) CDK2NT5ECDK1
SCHEMBL22843528 0.72 NT5E (0.57) NT5EENPP1
SCHEMBL19370351 0.70 NT5E (0.50) CDK2NT5ECDK1
SCHEMBL21283410 0.69 TMIGD3 (0.52) CDK2CDK1RAB9AKMT2ATMIGD3

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 P2RY1 76/4885CDK2 4092/4885MAPK1 4187/4885
US-11667662-B2 Modulators of 5′-nucleotidase, ecto and the use thereof ENTPD5, NT5C2, NT5E P2RY1 75/4885CDK2 4053/4885MAPK1 4163/4885

“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.

Send feedback