SCHEMBL29588669

SCHEMBL29588669

COc1cc2ncnc(N3CC(CCNC(C)=O)C3)c2cc1OC

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.57
BACE1 P56817 2/20 0.57
ENPP1 P22413 6/20 0.56
MAPK1 P28482 1/20 0.53
PDGFRB P09619 8/20 0.52
PDGFRA P16234 7/20 0.52
AURKA O14965 1/20 0.51
PDE10A Q9Y233 2/20 0.50

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
SCHEMBL24391804 1.00 ACHE (0.57) ACHEBACE1ENPP1MAPK1PDGFRB
SCHEMBL24391714 0.90 ENPP1 (0.57) ACHEBACE1ENPP1MAPK1PDGFRB
SCHEMBL22407367 0.89 ENPP1 (0.70) ACHEBACE1ENPP1MAPK1PDGFRB
SCHEMBL31153227 0.87 ENPP1 (0.54) ACHEBACE1ENPP1MAPK1PDGFRB
SCHEMBL24392429 0.87 ENPP1 (0.54) ACHEBACE1ENPP1MAPK1PDGFRB
SCHEMBL24391704 0.83 ACHE (0.58) ACHEBACE1ENPP1MAPK1PDGFRB
SCHEMBL29589572 0.83 ACHE (0.58) ACHEBACE1ENPP1MAPK1PDGFRB
SCHEMBL24391683 0.83 ENPP1 (0.67) ACHEBACE1ENPP1MAPK1PDGFRB
SCHEMBL24391600 0.83 ENPP1 (0.67) ACHEBACE1ENPP1MAPK1PDGFRB
SCHEMBL29588791 0.83 ENPP1 (0.67) ACHEBACE1ENPP1MAPK1PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12325720-B2 Ectonucleotide pyrophosphatase-phosphodiesterase-1 (ENPP1) inhibitors and uses thereof 1CBIO, INC. (US) 2025-06-10 US disclosed
US-20240352046-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF 1CBIO INC (US) 2024-10-24 US disclosed
CN-116848091-A Inhibitors of ectonucleotide pyrophosphatase-phosphodiesterase-1 (ENPP 1) and uses thereof 1CBIO公司 2023-10-03 CN disclosed
EP-4236928-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF 1Cbio, Inc. (US) 2023-09-06 EP disclosed
WO-2022091048-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) 2022-05-05 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-20240352046-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF ENPP1, ENPP3, ENPP2 ACHE 208/4885BACE1 947/4885ENPP1 1/4885
US-12325720-B2 Ectonucleotide pyrophosphatase-phosphodiesterase-1 (ENPP1) inhibitors and uses thereof ENPP1, ENPP3, ENPP2 ACHE 208/4885BACE1 947/4885ENPP1 1/4885

“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.