SCHEMBL21098275

SCHEMBL21098275

COC(=O)N1CCC[C@@H](Nc2nc(Cl)nc3c2SCC3)C1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 10/20 0.41
▸ JAK2 O60674 6/20 0.41
▸ PDE4D Q08499 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.35
▸ GFER P55789 2/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ BTK Q06187 2/20 0.33
▸ MAPK3 P27361 1/20 0.33
▸ EGFR P00533 1/20 0.33

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
SCHEMBL29489171 1.00 JAK3 (0.41) JAK3JAK2PDE4DTDP1GFER
SCHEMBL23084452 1.00 JAK3 (0.41) JAK3JAK2PDE4DTDP1GFER
SCHEMBL29489168 1.00 JAK3 (0.41) JAK3JAK2PDE4DTDP1GFER
SCHEMBL21098279 1.00 JAK3 (0.41) JAK3JAK2PDE4DTDP1GFER
SCHEMBL29489173 0.94 JAK2 (0.42) JAK3JAK2PDE4DTDP1KMT2A
SCHEMBL28472769 0.94 JAK2 (0.42) JAK3JAK2PDE4DTDP1KMT2A
SCHEMBL21098225 0.94 JAK2 (0.42) JAK3JAK2PDE4DTDP1KMT2A
SCHEMBL23084516 0.94 JAK2 (0.42) JAK3JAK2PDE4DTDP1KMT2A
SCHEMBL29489172 0.94 JAK2 (0.42) JAK3JAK2PDE4DTDP1KMT2A
SCHEMBL8256499 0.90 PIM1 (0.40) KMT2ABTK

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
CN-111712502-B Substituted azetidine dihydro-thienopyrimidines and their use as phosphodiesterase inhibitors 联合疗法公司 2023-10-27 — — CN disclosed
US-20210070769-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION therapeutics A/S (DK) 2021-03-11 — — US disclosed
CN-111712502-A Substituted azetidine dihydrothienopyrimidines and their use as phosphodiesterase inhibitors 利奥制药有限公司 2020-09-25 — — CN disclosed
WO-2019115774-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS LEO PHARMA A/S (DK) 2019-06-20 — — WO 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-20210070769-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS PDE2A, PDE5A, PDE3A JAK3 2612/4885JAK2 1796/4885PDE4D 12/4885

“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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