SCHEMBL26907848

SCHEMBL26907848

COc1cccc2nnn(-c3ccc(CN[SH](=O)=O)cc3)c12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ ALDH1A1 P00352 7/20 0.34
▸ EGFR P00533 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ RXFP1 Q9HBX9 1/20 0.34
▸ NR2E3 Q9Y5X4 1/20 0.34
▸ NCOR2 Q9Y618 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ NPSR1 Q6W5P4 3/20 0.33
▸ LMNA P02545 3/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ GAA P10253 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL26907888 0.82 GRM2 (0.42) ALDH1A1POLBKMT2ANPSR1LMNA
SCHEMBL27116880 0.81 ENPP1 (0.42) ALDH1A1LMNASMN1; SMN2MAPTHTT
SCHEMBL26907911 0.81 ALDH1A1 (0.35) ALDH1A1MEN1POLBKMT2AL3MBTL1
SCHEMBL26908012 0.78 SMN1; SMN2 (0.35) ALDH1A1MEN1POLBKMT2AL3MBTL1
SCHEMBL26908033 0.77 CHRM4 (0.36) PIM1ALDH1A1EGFRMEN1POLB
SCHEMBL26907944 0.77 SMN1; SMN2 (0.43) ALDH1A1MEN1KMT2AL3MBTL1RAB9A
SCHEMBL26907937 0.75 HDAC3 (0.40) PIM1ALDH1A1MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL26907872 0.74 SMO (0.40) FGFR1ALDH1A1POLBL3MBTL1LMNA
SCHEMBL29069573 0.74 ALDH1A1 (0.40) FGFR1ALDH1A1KMT2ANPSR1LMNA
SCHEMBL26907865 0.74 TSHR (0.36) ALDH1A1MEN1KMT2AL3MBTL1LMNA

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-20240116882-A1 NOVEL BENZOTRIAZOLE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE, AND USE THEREOF TXINNO BIOSCIENCE INC. (KR) 2024-04-11 — — US claimed
EP-4286374-A1 NOVEL BENZOTRIAZOLE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE, AND USE THEREOF Txinno Bioscience Inc. (KR) 2023-12-06 — — EP claimed
CN-116724026-A Novel benzotriazole derivatives having inhibitory activity against dinucleotide pyrophosphatase-phosphodiesterase and use thereof 谛希诺生物科技有限公司 2023-09-08 — — CN claimed
US-20240116882-A1 NOVEL BENZOTRIAZOLE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE, AND USE THEREOF TXINNO BIOSCIENCE INC. (KR) 2024-04-11 — — US disclosed
EP-4286374-A1 NOVEL BENZOTRIAZOLE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE, AND USE THEREOF Txinno Bioscience Inc. (KR) 2023-12-06 — — EP disclosed
CN-116724026-A Novel benzotriazole derivatives having inhibitory activity against dinucleotide pyrophosphatase-phosphodiesterase and use thereof 谛希诺生物科技有限公司 2023-09-08 — — 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-20240116882-A1 NOVEL BENZOTRIAZOLE DERIVATIVE HAVING INHIBITORY ACTIVITY AGAINST ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE, AND USE THEREOF ENPP1, ENPP3, TPP1 FGFR1 3696/4885PIM1 2925/4885ALDH1A1 1912/4885

“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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