SCHEMBL25656017

SCHEMBL25656017

Cc1cc2c(N3CCCN(S(N)(=O)=O)CC3)ncnc2cc1OC=O

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 13/20 0.70
ACHE P22303 4/20 0.43
BACE1 P56817 4/20 0.43
PDE10A Q9Y233 1/20 0.40
KIT P10721 1/20 0.40

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
SCHEMBL25656000 0.86 ENPP1 (0.73) ENPP1ACHEBACE1
SCHEMBL25656134 0.85 ENPP1 (0.80) ENPP1ACHEBACE1KIT
SCHEMBL25656114 0.83 ENPP1 (0.67) ENPP1ACHEBACE1
SCHEMBL23727268 0.83 ENPP1 (1.00) ENPP1ACHEBACE1PDE10A
SCHEMBL25656022 0.83 ENPP1 (0.69) ENPP1ACHEBACE1
Hydrochloric Acid SCHEMBL23726377 0.82 ENPP1 (0.98) ENPP1ACHEBACE1PDE10A
SCHEMBL25656109 0.79 ENPP1 (0.64) ENPP1ACHEBACE1
SCHEMBL23726805 0.79 ENPP1 (0.92) ENPP1ACHEBACE1PDE10A
SCHEMBL25656108 0.79 ENPP1 (0.66) ENPP1ACHEBACE1
SCHEMBL23762347 0.78 ENPP1 (0.85) ENPP1ACHEBACE1PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230183212-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF STINGRAY THERAPEUTICS INC (US) 2023-06-15 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-20230183212-A1 INHIBITORS OF ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE 1 (ENPP1) AND METHODS OF USE THEREOF ENPP1, ENPP3, PPA1 ENPP1 1/4885ACHE 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.