SCHEMBL30401491

SCHEMBL30401491

O=C(O)c1ccc(Sc2cnccc2C(=O)O)c([N+](=O)[O-])c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
PDE7A Q13946 2/20 0.54
APEX1 P27695 1/20 0.52
POLB P06746 3/20 0.52
MEN1 O00255 2/20 0.52
HPGD P15428 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 4/20 0.51
KDM4E B2RXH2 1/20 0.51
CASP6 P55212 1/20 0.49
MAPT P10636 4/20 0.47
GFER P55789 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
BCL2L1 Q07817 1/20 0.47
TSHR P16473 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
PDE4B Q07343 1/20 0.43
PDE4D Q08499 1/20 0.43
PDE7B Q9NP56 1/20 0.43
HCAR3 P49019 2/20 0.43

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
SCHEMBL19984746 1.00 ALDH1A1 (0.58) ALDH1A1PDE7AAPEX1POLBMEN1
SCHEMBL4003277 0.82 LMNA (0.68) ALDH1A1APEX1POLBMEN1HPGD
SCHEMBL19975009 0.81 MAPT (0.54) ALDH1A1PDE7APOLBMEN1HPGD
SCHEMBL30402131 0.79 KDM4E (0.66) ALDH1A1MEN1HPGDKMT2ALMNA
SCHEMBL19984538 0.79 KDM4E (0.66) ALDH1A1MEN1HPGDKMT2ALMNA
SCHEMBL4005302 0.79 APEX1 (0.53) ALDH1A1PDE7AAPEX1POLBMEN1
SCHEMBL4001613 0.79 BCL2L1 (0.60) ALDH1A1PDE7AAPEX1POLBMEN1
SCHEMBL4637151 0.77 APEX1 (0.54) ALDH1A1PDE7AAPEX1POLBMEN1
SCHEMBL4002024 0.77 POLB (0.61) ALDH1A1PDE7AAPEX1POLBMEN1
SCHEMBL8217069 0.75 ALDH1A1 (0.68) ALDH1A1PDE7AAPEX1POLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250064060-A1 BIS(HETERO)ARYL THIOETHER (THIO)AMIDES AS FUNGICIDAL COMPOUNDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2025-02-27 US claimed
EP-4426677-A1 BIS(HETERO)ARYL THIOETHER (THIO)AMIDES AS FUNGICIDAL COMPOUNDS Bayer Aktiengesellschaft (DE) 2024-09-11 EP claimed
CN-118541353-A Bis (hetero) aryl thioether (thio) amides as fungicidal compounds 拜耳公司 2024-08-23 CN claimed
WO-2023078915-A1 BIS(HETERO)ARYL THIOETHER (THIO)AMIDES AS FUNGICIDAL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2023-05-11 WO claimed
US-20250064060-A1 BIS(HETERO)ARYL THIOETHER (THIO)AMIDES AS FUNGICIDAL COMPOUNDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2025-02-27 US disclosed
US-20250042886-A1 BIS(HETERO)ARYL THIOETHER OXADIAZINES AS FUNGICIDAL COMPOUNDS BAYER S.A.S. (FR) 2025-02-06 US disclosed
EP-4441049-A1 BIS(HETERO)ARYL THIOETHER OXADIAZINES AS FUNGICIDAL COMPOUNDS Bayer Aktiengesellschaft (DE) 2024-10-09 EP disclosed
EP-4426677-A1 BIS(HETERO)ARYL THIOETHER (THIO)AMIDES AS FUNGICIDAL COMPOUNDS Bayer Aktiengesellschaft (DE) 2024-09-11 EP disclosed
CN-118541353-A Bis (hetero) aryl thioether (thio) amides as fungicidal compounds 拜耳公司 2024-08-23 CN disclosed
CN-118317956-A Bis (hetero) aryl thioether oxadiazines as fungicidal compounds 拜耳公司 2024-07-09 CN disclosed
WO-2023099445-A1 BIS(HETERO)ARYL THIOETHER OXADIAZINES AS FUNGICIDAL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2023-06-08 WO disclosed
WO-2023078915-A1 BIS(HETERO)ARYL THIOETHER (THIO)AMIDES AS FUNGICIDAL COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 2023-05-11 WO 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 (2 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-20250042886-A1 BIS(HETERO)ARYL THIOETHER OXADIAZINES AS FUNGICIDAL COMPOUNDS CYP4Z1, STS, HPD ALDH1A1 2470/4885PDE7A 3482/4885APEX1 538/4885
US-20250064060-A1 BIS(HETERO)ARYL THIOETHER (THIO)AMIDES AS FUNGICIDAL COMPOUNDS TST, TPMT, NAT1 ALDH1A1 2628/4885PDE7A 3827/4885APEX1 810/4885

“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.