SCHEMBL25656109

SCHEMBL25656109

Cc1cc2c(N3CCCN(S(N)(=O)=O)CC3)ncnc2cc1C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 12/20 0.64
ACHE P22303 1/20 0.41
BACE1 P56817 1/20 0.41
GBA1 P04062 1/20 0.40
RAB9A P51151 1/20 0.40
AURKA O14965 1/20 0.39
PDGFRB P09619 3/20 0.39
PDGFRA P16234 1/20 0.39
KRAS P01116 1/20 0.38

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
SCHEMBL25656108 0.89 ENPP1 (0.66) ENPP1ACHEBACE1AURKAPDGFRB
SCHEMBL25656000 0.88 ENPP1 (0.73) ENPP1ACHEBACE1GBA1RAB9A
SCHEMBL25656022 0.87 ENPP1 (0.69) ENPP1ACHEBACE1GBA1RAB9A
SCHEMBL23727128 0.87 ENPP1 (0.79) ENPP1ACHEBACE1AURKAPDGFRB
SCHEMBL25656114 0.81 ENPP1 (0.67) ENPP1ACHEBACE1RAB9AAURKA
SCHEMBL25656107 0.81 ENPP1 (0.55) ENPP1ACHEBACE1AURKAPDGFRB
SCHEMBL23762295 0.80 ENPP1 (0.77) ENPP1ACHEBACE1AURKAPDGFRB
SCHEMBL25656017 0.79 ENPP1 (0.70) ENPP1ACHEBACE1
SCHEMBL25656116 0.79 ENPP1 (0.58) ENPP1ACHEBACE1GBA1RAB9A
Hydrochloric Acid SCHEMBL23726498 0.79 ENPP1 (0.76) ENPP1ACHEBACE1AURKAPDGFRB

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.