SCHEMBL23630615

SCHEMBL23630615

[CH2]/C=C/c1ccccc1.[Pd]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 3/20 0.55
▸ ALDH1A1 P00352 4/20 0.48
▸ TSHR P16473 1/20 0.48
▸ LMNA P02545 2/20 0.46
▸ NFE2L2 Q16236 2/20 0.46
▸ CYP19A1 P11511 2/20 0.46
▸ MAOA P21397 2/20 0.46
▸ TRPA1 O75762 2/20 0.46
▸ ALOX5 P09917 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HDAC3 O15379 1/20 0.44
▸ TNKS O95271 1/20 0.44
▸ HDAC4 P56524 1/20 0.44
▸ HDAC1 Q13547 1/20 0.44
▸ HCAR2 Q8TDS4 1/20 0.44
▸ HDAC7 Q8WUI4 1/20 0.44
▸ HDAC2 Q92769 1/20 0.44
▸ HDAC10 Q969S8 1/20 0.44
▸ HDAC11 Q96DB2 1/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44

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
SCHEMBL5966228 0.97 — —
SCHEMBL2340 0.97 — —
SCHEMBL2341 0.97 — —
SCHEMBL27861093 0.94 — —
SCHEMBL27499452 0.94 MAOB (0.55) MAOBALDH1A1TSHRLMNANFE2L2
Water SCHEMBL28448011 0.94 MAOB (0.55) MAOBALDH1A1TSHRLMNANFE2L2
SCHEMBL28627434 0.94 MAOB (0.55) MAOBALDH1A1TSHRLMNANFE2L2
SCHEMBL8428975 0.94 MAOB (0.55) MAOBALDH1A1TSHRLMNANFE2L2
SCHEMBL28440624 0.89 MAOB (0.50) MAOBALDH1A1TSHRLMNANFE2L2
SCHEMBL17002705 0.89 MAOB (0.50) MAOBALDH1A1TSHRLMNANFE2L2

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4281436-A1 SYNTHESIS OF POLYFLUORINATED ARYL AND HETEROARYL CARBOXAMIDES BASF SE (DE) 2023-11-29 — — EP claimed
WO-2022157106-A1 SYNTHESIS OF POLYFLUORINATED ARYL AND HETEROARYL CARBOXAMIDES BASF SE (DE) 2022-07-28 — — WO claimed
CN-107488089-A Have axial chirality and the high optical activity allenic compound and its construction method of central chirality and application concurrently 浙江大学 2017-12-19 — — CN claimed
US-20260125392-A1 URACIL DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME SHIONOGI & CO., LTD. (JP) 2026-05-07 — — US disclosed
US-20260125365-A1 TRIAZINE DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME SHIONOGI & CO., LTD. (JP) 2026-05-07 — — US disclosed
US-12559474-B2 Triazine derivatives having virus replication inhibitory activity and pharmaceutical composition comprising the same SHIONOGI & CO., LTD. (JP) 2026-02-24 — — US disclosed
US-12545687-B2 Uracil derivatives having virus replication inhibitory activity and pharmaceutical composition comprising the same SHIONOGI & CO., LTD. (JP) 2026-02-10 — — US disclosed
WO-2025074997-A1 CONDENSED HETEROCYCLIC DERIVATIVE HAVING VIRAL PROLIFERATION INHIBITORY ACTIVITY, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME 塩野義製薬株式会社 2025-04-10 — — WO disclosed
US-20250092056-A1 URACIL DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME SHIONOGI & CO., LTD. (JP) 2025-03-20 — — US disclosed
CN-115244063-B Ligands for transition metal catalysts 罗特格斯新泽西州立大学 2025-03-07 — — CN disclosed
EP-4506342-A1 URACIL DERIVATIVE HAVING VIRAL GROWTH INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Shionogi & Co., Ltd (JP) 2025-02-12 — — EP disclosed
CN-115850249-A Triazine derivatives having virus proliferation inhibitory activity and pharmaceutical composition containing the same 盐野义制药株式会社 2023-03-28 — — CN disclosed
EP-4122926-A1 TRIAZINE DERIVATIVE HAVING VIRUS PROPAGATION INHIBITORY EFFECT, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Shionogi & Co., Ltd (JP) 2023-01-25 — — EP disclosed
CN-115244063-A Ligands for transition metal catalysts 罗特格斯新泽西州立大学 2022-10-25 — — CN disclosed
CN-115038696-A Triazine derivatives having virus proliferation inhibitory activity and pharmaceutical composition containing the same 盐野义制药株式会社 2022-09-09 — — CN disclosed
WO-2022157106-A1 SYNTHESIS OF POLYFLUORINATED ARYL AND HETEROARYL CARBOXAMIDES BASF SE (DE) 2022-07-28 — — WO disclosed
WO-2022138987-A1 TRIAZINE DERIVATIVE HAVING VIRUS PROPAGATION INHIBITORY EFFECT, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME 塩野義製薬株式会社 2022-06-30 — — WO disclosed
WO-2021142281-A1 LIGANDS FOR TRANSITION METAL CATALYSTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2021-07-15 — — WO disclosed
CN-107531698-A With the active fused bicyclic heteroaryl group derivative as PHD inhibitor 武田药品工业株式会社 2018-01-02 — — CN disclosed
CN-107488089-A Have axial chirality and the high optical activity allenic compound and its construction method of central chirality and application concurrently 浙江大学 2017-12-19 — — 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 (5 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-20260125392-A1 URACIL DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME SARS1, ACE, RNGTT MAOB 1094/4885ALDH1A1 2694/4885TSHR 2539/4885
US-20250092056-A1 URACIL DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME ACE, SARS1, RNASEL MAOB 458/4885ALDH1A1 1966/4885TSHR 2531/4885
US-12559474-B2 Triazine derivatives having virus replication inhibitory activity and pharmaceutical composition comprising the same NSUN2, ZC3HAV1, IFNAR1 MAOB 2531/4885ALDH1A1 4040/4885TSHR 1137/4885
US-12545687-B2 Uracil derivatives having virus replication inhibitory activity and pharmaceutical composition comprising the same SARS1, ACE, ACE2 MAOB 1526/4885ALDH1A1 2836/4885TSHR 3839/4885
US-20260125365-A1 TRIAZINE DERIVATIVES HAVING VIRUS REPLICATION INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME ACE2, ACE, SARS1 MAOB 2044/4885ALDH1A1 4080/4885TSHR 2348/4885

“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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