SCHEMBL23828527

SCHEMBL23828527

Nc1cn2ncnc2c(-c2ccco2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.47
▸ MEN1 O00255 3/20 0.47
▸ POLB P06746 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ PKM P14618 3/20 0.47
▸ ALOX15 P16050 3/20 0.47
▸ CASP1 P29466 3/20 0.47
▸ BLM P54132 3/20 0.47
▸ CASP7 P55210 3/20 0.47
▸ KMT2A Q03164 3/20 0.47
▸ HSD17B10 Q99714 3/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ HPGD P15428 2/20 0.47
▸ PTPN7 P35236 2/20 0.47
▸ RECQL P46063 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ THRB P10828 1/20 0.47

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
SCHEMBL23828393 0.76 ADORA2A (0.35) ALDH1A1MAPTPKMKDM4EHPGD
SCHEMBL2114343 0.68 MAPT (1.00) ALDH1A1MEN1POLBMAPTPKM
SCHEMBL5653328 0.67 ADORA2A (0.46) ALDH1A1MEN1POLBMAPTPKM
SCHEMBL21535583 0.66 DYRK1A (0.37) ALDH1A1MEN1KMT2AHSD17B10HPGD
SCHEMBL3063409 0.65 MAPT (0.50) ALDH1A1MEN1POLBMAPTPKM
SCHEMBL9287540 0.65 KDM4E (0.42) ALDH1A1MEN1POLBMAPTPKM
SCHEMBL22270711 0.64 DYRK1A (0.43) ALDH1A1MEN1POLBMAPTPKM
SCHEMBL129832 0.62 PIK3CD (0.55) ALDH1A1MEN1POLBMAPTPKM
SCHEMBL23998477 0.62 MAPT (0.42) ALDH1A1MEN1POLBMAPTPKM
SCHEMBL3058599 0.61 ADORA2B (0.57) ALDH1A1MEN1POLBMAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12264161-B2 Heterocyclic adenosine receptor antagonists EXELIXIS, INC. (US) 2025-04-01 — — US disclosed
US-20230382917-A1 Heterocyclic Adenosine Receptor Antagonists EXELIXIS, INC. 2023-11-30 — — US disclosed
US-11718622-B2 Heterocyclic adenosine receptor antagonists EXELIXIS INC. (US) 2023-08-08 — — US disclosed
US-20210292332-A1 Heterocyclic Adenosine Receptor Antagonists EXELIXIS, INC. 2021-09-23 — — 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 (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-20210292332-A1 Heterocyclic Adenosine Receptor Antagonists ADORA2A, ADORA1, ADORA3 ALDH1A1 789/4885MEN1 4346/4885POLB 2616/4885
US-20230382917-A1 Heterocyclic Adenosine Receptor Antagonists ADORA2A, ADORA1, ADORA3 ALDH1A1 789/4885MEN1 4346/4885POLB 2616/4885
US-11718622-B2 Heterocyclic adenosine receptor antagonists ADORA2A, ADORA1, ADORA3 ALDH1A1 789/4885MEN1 4346/4885POLB 2616/4885
US-12264161-B2 Heterocyclic adenosine receptor antagonists ADORA2A, ADORA1, ADORA3 ALDH1A1 789/4885MEN1 4346/4885POLB 2616/4885

“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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