SCHEMBL23068546

SCHEMBL23068546

O=C(O)N1CC[C@H](Nc2nc(Cl)nc3c2SCC3)C1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ PDE4D Q08499 2/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ ADORA3 P0DMS8 6/20 0.31
▸ SPR P35270 1/20 0.31
▸ JAK2 O60674 4/20 0.31
▸ JAK3 P52333 4/20 0.31
▸ CCNK O75909 1/20 0.31
▸ CDK12 Q9NYV4 1/20 0.31
▸ EGFR P00533 1/20 0.30
▸ ADORA1 P30542 2/20 0.30
▸ ADORA2A P29274 1/20 0.30
▸ PDE4B Q07343 1/20 0.30
▸ TSHR P16473 1/20 0.30

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
SCHEMBL23068547 1.00 KMT2A (0.33) KMT2AMEN1PDE4DTDP1ADORA3
SCHEMBL21061357 1.00 KMT2A (0.33) KMT2AMEN1PDE4DTDP1ADORA3
SCHEMBL23068541 0.93 JAK3 (0.36) KMT2ATDP1ADORA3JAK2JAK3
SCHEMBL21061348 0.93 JAK3 (0.36) KMT2ATDP1ADORA3JAK2JAK3
SCHEMBL23068542 0.93 JAK3 (0.36) KMT2ATDP1ADORA3JAK2JAK3
SCHEMBL20851937 0.90 JAK3 (0.40) KMT2AMEN1ADORA3JAK2JAK3
SCHEMBL20838977 0.90 JAK3 (0.40) KMT2AMEN1ADORA3JAK2JAK3
SCHEMBL20838962 0.90 JAK3 (0.40) KMT2AMEN1ADORA3JAK2JAK3
SCHEMBL23084516 0.88 JAK2 (0.42) KMT2AMEN1PDE4DTDP1JAK2
SCHEMBL21098225 0.88 JAK2 (0.42) KMT2AMEN1PDE4DTDP1JAK2

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
EP-3724194-B1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION THERAPEUTICS AS (DK) 2023-12-27 — — EP disclosed
US-20210070769-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS UNION therapeutics A/S (DK) 2021-03-11 — — 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-20210070769-A1 SUBSTITUTED AZETIDINE DIHYDROTHIENOPYRIMIDINES AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS PDE2A, PDE5A, PDE3A KMT2A 2334/4885MEN1 2445/4885PDE4D 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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