SCHEMBL26679912

SCHEMBL26679912

O=c1ccc2c(-c3ccc(CN[SH](=O)=O)c(F)c3)ccnc2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 8/20 0.39
▸ ENPP1 P22413 1/20 0.38
▸ CDK9 P50750 6/20 0.37
▸ CCNT1 O60563 5/20 0.37
▸ PDE3B Q13370 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ IKBKB O14920 3/20 0.34
▸ CHUK O15111 3/20 0.34
▸ PRKCI P41743 1/20 0.34
▸ CASP3 P42574 1/20 0.33
▸ CASP7 P55210 1/20 0.33
▸ ROCK1 Q13464 1/20 0.33

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
Hydrochloric Acid SCHEMBL26679901 0.90 CDK9 (0.37) CDK9CCNT1PDE3BPDE3AIKBKB
SCHEMBL29248823 0.86 BTK (0.42) BTKENPP1CDK9CCNT1PDE3B
Hydrochloric Acid SCHEMBL29691577 0.85 ENPP1 (0.42) BTKENPP1CDK9CCNT1PDE3B
Hydrochloric Acid SCHEMBL26679856 0.85 ENPP1 (0.42) BTKENPP1CDK9CCNT1PDE3B
SCHEMBL26877271 0.84 BTK (0.41) BTKENPP1CDK9CCNT1PDE3B
SCHEMBL24600499 0.84 BTK (0.40) BTKENPP1CDK9CCNT1PDE3B
Hydrochloric Acid SCHEMBL26679799 0.83 ENPP1 (0.41) BTKENPP1CDK9CCNT1PDE3B
Hydrochloric Acid SCHEMBL29691622 0.83 ENPP1 (0.41) BTKENPP1CDK9CCNT1PDE3B
Hydrochloric Acid SCHEMBL29691615 0.83 BTK (0.39) BTKENPP1CDK9CCNT1PDE3B
Hydrochloric Acid SCHEMBL26679831 0.83 BTK (0.39) BTKENPP1CDK9CCNT1PDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240140944-A1 NOVEL NAPHTHYRIDINONE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE AND USE THEREOF TXINNO BIOSCIENCE INC. (KR) 2024-05-02 — — US claimed
EP-4276100-A1 NOVEL NAPHTHYRIDINONE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE AND USE THEREOF Txinno Bioscience Inc. (KR) 2023-11-15 — — EP claimed
CN-116669726-A Novel naphthyridinone derivatives having inhibitory activity against exonuclease-phosphodiesterase and use thereof 谛希诺生物科技有限公司 2023-08-29 — — CN claimed
US-20240140944-A1 NOVEL NAPHTHYRIDINONE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE AND USE THEREOF TXINNO BIOSCIENCE INC. (KR) 2024-05-02 — — US disclosed
EP-4276100-A1 NOVEL NAPHTHYRIDINONE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE AND USE THEREOF Txinno Bioscience Inc. (KR) 2023-11-15 — — EP disclosed
CN-116669726-A Novel naphthyridinone derivatives having inhibitory activity against exonuclease-phosphodiesterase and use thereof 谛希诺生物科技有限公司 2023-08-29 — — CN 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-20240140944-A1 NOVEL NAPHTHYRIDINONE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE AND USE THEREOF ENPP1, ENPP3, ENTPD5 BTK 3874/4885ENPP1 1/4885CDK9 1169/4885

“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.

Send feedback