SCHEMBL23726540

SCHEMBL23726540

COc1cc2c(N3CCCN(C(=O)OC(C)(C)C)CC3)ncnc2cc1O

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 2/20 0.65
ACHE P22303 1/20 0.58
BACE1 P56817 1/20 0.58
ENPP1 P22413 4/20 0.57
AURKA O14965 1/20 0.54
PDGFRB P09619 10/20 0.52
PDGFRA P16234 4/20 0.52
TLR7 Q9NYK1 1/20 0.49
MAPK7 Q13164 1/20 0.49
KIT P10721 1/20 0.49

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
SCHEMBL30080209 1.00 TLR9 (0.65) TLR9ACHEBACE1ENPP1AURKA
SCHEMBL906154 0.96 TLR9 (0.69) TLR9ACHEBACE1ENPP1AURKA
SCHEMBL23726903 0.93 ACHE (0.67) ACHEBACE1ENPP1AURKAPDGFRB
SCHEMBL29055014 0.87 ACHE (0.64) ACHEBACE1ENPP1AURKAPDGFRB
SCHEMBL30080204 0.85 ENPP1 (0.66) TLR9ACHEBACE1ENPP1AURKA
SCHEMBL23726390 0.85 ENPP1 (0.66) TLR9ACHEBACE1ENPP1AURKA
SCHEMBL21415489 0.85 ACHE (0.61) TLR9ACHEBACE1ENPP1AURKA
SCHEMBL25656100 0.85 KIT (0.53) TLR9ACHEBACE1ENPP1AURKA
SCHEMBL23726611 0.84 TLR9 (0.71) TLR9ACHEBACE1ENPP1AURKA
SCHEMBL30080195 0.84 TLR9 (0.71) TLR9ACHEBACE1ENPP1AURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4100394-B1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF STINGRAY THERAPEUTICS INC (US) 2026-04-08 EP disclosed
US-20250092018-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF STINGRAY THERAPEUTICS INC (US) 2025-03-20 US disclosed
US-12152015-B2 Inhibitors of ectonucleotide pyrophosphatase/phosphodiesterase 1 (ENPP1) and methods of use thereof Stingray Therapeutics, Inc. (US) 2024-11-26 US disclosed
US-20230183212-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF STINGRAY THERAPEUTICS INC (US) 2023-06-15 US disclosed
US-11591313-B2 Inhibitors of ectonucleotide pyrophosphatase/phosphodiesterase 1 (ENPP1) and methods of use thereof Stingray Therapeutics, Inc. (US) 2023-02-28 US disclosed
EP-4100394-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF Stingray Therapeutics, Inc. (US) 2022-12-14 EP disclosed
CN-115362145-A Ecto-nucleotide pyrophosphatase/phosphodiesterase 1 (ENPP 1) inhibitors and methods of use thereof 斯汀格瑞治疗股份有限公司 2022-11-18 CN disclosed
US-20210253556-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF Stingray Therapeutics, Inc. 2021-08-19 US disclosed
WO-2021158829-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF Stingray Therapeutics, Inc. (US) 2021-08-12 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 (5 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-20230183212-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF ENPP1, ENPP3, PPA1 TLR9 2494/4885ACHE 939/4885BACE1 1502/4885
US-11591313-B2 Inhibitors of ectonucleotide pyrophosphatase/phosphodiesterase 1 (ENPP1) and methods of use thereof ENPP1, ENPP3, PPA1 TLR9 2494/4885ACHE 939/4885BACE1 1502/4885
US-20210253556-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF ENPP1, ENPP3, PPA1 TLR9 2494/4885ACHE 939/4885BACE1 1502/4885
US-20250092018-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF ENPP1, ENPP3, PDE7A TLR9 2047/4885ACHE 721/4885BACE1 896/4885
US-12152015-B2 Inhibitors of ectonucleotide pyrophosphatase/phosphodiesterase 1 (ENPP1) and methods of use thereof ENPP1, ENPP3, PPA1 TLR9 2494/4885ACHE 939/4885BACE1 1502/4885

“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.