SCHEMBL20975225

SCHEMBL20975225

Nc1ncnc2c1ncn2CCCCOC(=O)N1CCC2CCCCC2C1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ADCY5 O95622 4/20 0.49
▸ ADORA2A P29274 4/20 0.47
▸ FGFR1 P11362 2/20 0.43
▸ ADORA1 P30542 2/20 0.43
▸ SLC22A6 Q4U2R8 2/20 0.43
▸ PIK3CD O00329 1/20 0.42
▸ TRPM2 O94759 1/20 0.42
▸ PDE3A Q14432 1/20 0.41
▸ ADORA2B P29275 1/20 0.41
▸ ABCB11 O95342 1/20 0.40
▸ POLA1 P09884 1/20 0.40
▸ POLG P54098 1/20 0.40
▸ FAP Q12884 1/20 0.40
▸ NSD2 O96028 1/20 0.39
▸ NSD3 Q9BZ95 1/20 0.39

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
SCHEMBL19574928 0.88 ADCY5 (0.52) ADCY5ADORA2AFGFR1ADORA1SLC22A6
SCHEMBL20973636 0.88 ADCY5 (0.52) ADCY5ADORA2AFGFR1ADORA1SLC22A6
SCHEMBL19574931 0.88 ADCY5 (0.52) ADCY5ADORA2AFGFR1ADORA1SLC22A6
SCHEMBL19574926 0.85 ADCY5 (0.53) ADCY5ADORA2AFGFR1ADORA1SLC22A6
SCHEMBL20974519 0.85 ADCY5 (0.56) ADCY5ADORA2AFGFR1ADORA1SLC22A6
SCHEMBL20973331 0.84 ADCY5 (0.48) ADCY5ADORA2AFGFR1ADORA1SLC22A6
SCHEMBL19574925 0.82 ADCY5 (0.50) ADCY5ADORA2AFGFR1ADORA1SLC22A6
SCHEMBL20972819 0.82 ADORA2A (0.53) ADCY5ADORA2AFGFR1ADORA1SLC22A6
SCHEMBL20975226 0.81 ADCY5 (0.53) ADCY5ADORA2AFGFR1ADORA1SLC22A6
SCHEMBL20975063 0.80 ADCY5 (0.50) ADCY5ADORA2AFGFR1ADORA1SLC22A6

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-11236093-B2 Adenine derivatives as protein kinase inhibitors B.C.I. PHARMA (BE) 2022-02-01 — — US disclosed
US-20190127379-A1 ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS B.C.I. PHARMA (BE) 2019-05-02 — — 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-11236093-B2 Adenine derivatives as protein kinase inhibitors ADK, TNNI3K, TNK2 ADCY5 718/4885ADORA2A 195/4885FGFR1 853/4885
US-20190127379-A1 ADENINE DERIVATIVES AS PROTEIN KINASE INHIBITORS ADK, TNNI3K, TNK2 ADCY5 718/4885ADORA2A 195/4885FGFR1 853/4885

“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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