SCHEMBL25656115

SCHEMBL25656115

Cc1cc2c(N3CCCN(S(=O)(=O)NC(=O)OC(C)(C)C)CC3)ncnc2cc1OCC(N)=O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 13/20 0.50
LMNA P02545 3/20 0.42
SIRT2 Q8IXJ6 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
SIRT3 Q9NTG7 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GLA P06280 1/20 0.39
RAB9A P51151 1/20 0.39
AURKA O14965 1/20 0.38
ACHE P22303 1/20 0.38
BACE1 P56817 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
SCHEMBL23762506 0.91 ENPP1 (0.62) ENPP1AURKAACHEBACE1
SCHEMBL30117253 0.91 ENPP1 (0.62) ENPP1AURKAACHEBACE1
SCHEMBL25656098 0.88 ENPP1 (0.50) ENPP1SIRT2SIRT1SIRT3AURKA
SCHEMBL25656114 0.86 ENPP1 (0.67) ENPP1LMNASMN1; SMN2NPSR1GLA
SCHEMBL30117297 0.85 ENPP1 (0.66) ENPP1AURKAACHEBACE1
SCHEMBL23762283 0.85 ENPP1 (0.66) ENPP1AURKAACHEBACE1
SCHEMBL23726143 0.82 ENPP1 (0.67) ENPP1AURKAACHEBACE1
SCHEMBL23762311 0.81 ENPP1 (0.60) ENPP1AURKAACHEBACE1
SCHEMBL30117246 0.81 ENPP1 (0.60) ENPP1AURKAACHEBACE1
SCHEMBL25656111 0.80 ENPP1 (0.64) ENPP1LMNASIRT2SIRT1SIRT3

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 1/4885LMNA 3401/4885SIRT2 1843/4885

“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.