SCHEMBL30336748

SCHEMBL30336748

CC(C)(C)OC(=O)NS(=O)(=O)N1CCc2cc(-c3n[nH]c(=O)c4ccccc34)ccc2C1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ENPP1 P22413 1/20 0.47
▸ ROCK1 Q13464 10/20 0.46
▸ ROCK2 O75116 10/20 0.44
▸ NAMPT P43490 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL25546555 1.00 ENPP1 (0.47) ENPP1ROCK1ROCK2NAMPTALDH1A1
SCHEMBL30337022 0.89 ENPP1 (0.42) ENPP1ROCK1ROCK2ALDH1A1
SCHEMBL30088818 0.89 ENPP1 (0.42) ENPP1ROCK1ROCK2ALDH1A1
SCHEMBL24000619 0.89 ENPP1 (0.42) ENPP1ROCK1ROCK2ALDH1A1
SCHEMBL30088988 0.85 ENPP1 (0.67) ENPP1ALDH1A1MAPK1KMT2AHPGD
SCHEMBL25548011 0.85 ENPP1 (0.67) ENPP1ALDH1A1MAPK1KMT2AHPGD
SCHEMBL24000534 0.81 ROCK2 (0.56) ROCK1ROCK2NAMPT
SCHEMBL24000309 0.79 ENPP1 (0.67) ENPP1ROCK1ROCK2NAMPTALDH1A1
SCHEMBL24804969 0.79 TARS1 (0.66) ENPP1ROCK1
SCHEMBL30151465 0.79 TARS1 (0.66) ENPP1ROCK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159469-A1 NOVEL PHTHALAZINE DERIVATIVE HAVING ECTONUCLOEOTIDE PYROPHOSPHATASE/PHOSPHODIESTE RASE INHIBITORY ACTIVITY, AND USE THEREOF TXINNO BIOSCIENCE INC. (KR) 2023-05-25 — — US claimed
EP-4148046-A1 NOVEL PHTHALAZINE DERIVATIVE HAVING ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE INHIBITORY ACTIVITY, AND USE THEREOF Txinno Bioscience Inc. (KR) 2023-03-15 — — EP claimed
US-20230159469-A1 NOVEL PHTHALAZINE DERIVATIVE HAVING ECTONUCLOEOTIDE PYROPHOSPHATASE/PHOSPHODIESTE RASE INHIBITORY ACTIVITY, AND USE THEREOF TXINNO BIOSCIENCE INC. (KR) 2023-05-25 — — US disclosed
EP-4148046-A1 NOVEL PHTHALAZINE DERIVATIVE HAVING ECTONUCLEOTIDE PYROPHOSPHATASE/PHOSPHODIESTERASE INHIBITORY ACTIVITY, AND USE THEREOF Txinno Bioscience Inc. (KR) 2023-03-15 — — EP 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-20230159469-A1 NOVEL PHTHALAZINE DERIVATIVE HAVING ECTONUCLOEOTIDE PYROPHOSPHATASE/PHOSPHODIESTE RASE INHIBITORY ACTIVITY, AND USE THEREOF ENPP1, ENPP3, PPA1 ENPP1 1/4885ROCK1 1268/4885ROCK2 2177/4885

“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.

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