SCHEMBL24673464

SCHEMBL24673464

Nc1ncnc2c1ncn2[C@@H]1C[C@]2(CC[C@H]2N)C(O)C1O

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AHCY P23526 11/20 0.59
▸ ADORA2A P29274 3/20 0.55
▸ ADORA3 P0DMS8 2/20 0.55
▸ PI4K2A Q9BTU6 1/20 0.54
▸ SLC28A1 O00337 1/20 0.54
▸ SLC28A2 O43868 1/20 0.54
▸ ADORA2B P29275 1/20 0.52
▸ PRMT5 O14744 1/20 0.52
▸ WDR77 Q9BQA1 1/20 0.52

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
SCHEMBL24673138 1.00 AHCY (0.59) AHCYADORA2AADORA3PI4K2ASLC28A1
SCHEMBL25566624 0.75 SLC28A1 (0.60) AHCYADORA2AADORA3PI4K2ASLC28A1
SCHEMBL19503944 0.75 SLC28A1 (0.60) AHCYADORA2AADORA3PI4K2ASLC28A1
SCHEMBL12149495 0.75 AHCY (0.86) AHCYADORA2AADORA3SLC28A1SLC28A2
SCHEMBL29430167 0.75 AHCY (1.00) AHCYADORA2AADORA3ADORA2B
SCHEMBL12280207 0.75 AHCY (1.00) AHCYADORA2AADORA3ADORA2B
SCHEMBL10459031 0.75 AHCY (1.00) AHCYADORA2AADORA3ADORA2B
SCHEMBL12280226 0.75 AHCY (1.00) AHCYADORA2AADORA3ADORA2B
SCHEMBL10432751 0.75 AHCY (1.00) AHCYADORA2AADORA3ADORA2B
SCHEMBL2421602 0.75 AHCY (1.00) AHCYADORA2AADORA3ADORA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220275018-A1 NOVEL SPIROBICYCLIC INTERMEDIATES JANSSEN PHARMACEUTICA NV (BE) 2022-09-01 — — 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 (1 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-20220275018-A1 NOVEL SPIROBICYCLIC INTERMEDIATES NME2, SLC28A1, SLC28A2 AHCY 998/4885ADORA2A 148/4885ADORA3 656/4885

“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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