SCHEMBL23489806

SCHEMBL23489806

O=C(N[C@H]1CCN(C(=O)NC2CCCCC2)C1)O[C@@H]1CCN(c2cn[nH]c(=O)c2Cl)C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ KDM5A P29375 3/20 0.37
▸ KDM5B Q9UGL1 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ EPHX1 P07099 1/20 0.35
▸ TIPARP Q7Z3E1 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ MAPK1 P28482 1/20 0.34

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
SCHEMBL23608540 1.00 POLB (0.43) POLBALDH1A1KDM5AKDM5BLMNA
SCHEMBL23490498 0.96 POLB (0.44) POLBALDH1A1LMNAL3MBTL1HTT
SCHEMBL23490499 0.92 POLB (0.42) POLBALDH1A1KDM5BTIPARP
SCHEMBL23490303 0.92 POLB (0.50) POLBALDH1A1EPHX1TIPARP
SCHEMBL23490304 0.92 POLB (0.50) POLBALDH1A1EPHX1TIPARP
SCHEMBL23573176 0.92 POLB (0.50) POLBALDH1A1EPHX1TIPARP
SCHEMBL23489983 0.92 POLB (0.50) POLBALDH1A1EPHX1TIPARP
SCHEMBL23490463 0.92 POLB (0.50) POLBALDH1A1EPHX1TIPARP
SCHEMBL23490296 0.91 POLB (0.49) POLBALDH1A1EPHX1TIPARP
SCHEMBL23573422 0.91 POLB (0.49) POLBALDH1A1EPHX1TIPARP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12509444-B2 Compounds and methods for CD73 modulation and indications therefor PLEXXIKON INC. (US) 2025-12-30 — — US disclosed
US-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR PLEXXIKON INC. 2021-07-01 — — US disclosed
WO-2021113625-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR PLEXXIKON INC. (US) 2021-06-10 — — 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 (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-20210198239-A1 COMPOUNDS AND METHODS FOR CD73 MODULATION AND INDICATIONS THEREFOR ENTPD5, ADORA2A, ENTPD1 POLB 1763/4885ALDH1A1 216/4885KDM5A 3040/4885
US-12509444-B2 Compounds and methods for CD73 modulation and indications therefor ENTPD5, ADORA1, ADORA2A POLB 2540/4885ALDH1A1 114/4885KDM5A 3459/4885

“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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