SCHEMBL27180751

SCHEMBL27180751

O=C(Nc1cccc([N+](=O)[O-])c1)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.76
SENP8 Q96LD8 1/20 0.76
SENP7 Q9BQF6 1/20 0.76
SENP6 Q9GZR1 1/20 0.76
MEN1 O00255 8/20 0.63
KMT2A Q03164 8/20 0.63
ALDH1A1 P00352 3/20 0.63
MAPT P10636 4/20 0.62
POLB P06746 2/20 0.62
BLM P54132 1/20 0.62
KDM4E B2RXH2 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
LMNA P02545 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
SIRT2 Q8IXJ6 1/20 0.59
GPR17 Q13304 2/20 0.59
THRB P10828 1/20 0.59
PKM P14618 1/20 0.57
ADORA3 P0DMS8 1/20 0.57
SLC6A3 Q01959 1/20 0.57

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
SCHEMBL30926647 1.00 CASP3 (0.76) CASP3SENP8SENP7SENP6MEN1
SCHEMBL30926583 0.92 CASP3 (0.79) CASP3SENP8SENP7SENP6MEN1
SCHEMBL27179623 0.92 CASP3 (0.79) CASP3SENP8SENP7SENP6MEN1
SCHEMBL13532183 0.91 CASP3 (0.85) CASP3SENP8SENP7SENP6MEN1
SCHEMBL30927031 0.91 CASP3 (0.89) CASP3SENP8SENP7SENP6MEN1
SCHEMBL27179429 0.91 CASP3 (0.89) CASP3SENP8SENP7SENP6MEN1
SCHEMBL14125535 0.89 CASP3 (0.76) CASP3SENP8SENP7SENP6MEN1
SCHEMBL30926854 0.89 CASP3 (0.76) CASP3SENP8SENP7SENP6MEN1
SCHEMBL30926803 0.89 CASP3 (0.76) CASP3SENP8SENP7SENP6MEN1
SCHEMBL30926760 0.89 CASP3 (0.86) CASP3SENP8SENP7SENP6MEN1

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
EP-4580404-A2 SULFONAMIDE APYRASE INHIBITORS Texas Crop Science, Inc. (US) 2025-07-09 EP claimed
US-20240099300-A1 SULFONAMIDE APYRASE INHIBITORS TEXAS CROP SCIENCE, INC. 2024-03-28 US claimed
WO-2024050041-A2 SULFONAMIDE APYRASE INHIBITORS TEXAS CROP SCIENCE (US) 2024-03-07 WO claimed
US-20240099300-A1 SULFONAMIDE APYRASE INHIBITORS TEXAS CROP SCIENCE, INC. 2024-03-28 US 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-20240099300-A1 SULFONAMIDE APYRASE INHIBITORS APEH, ARSA, DNPEP CASP3 1111/4885SENP8 651/4885SENP7 716/4885

“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.