SCHEMBL25758307

SCHEMBL25758307

COc1ccc(NC(=O)c2cccc(-c3cncnc3)c2)cc1S(=O)(=O)Nc1c(C)cccc1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.53
HCRTR2 O43614 4/20 0.52
HCRTR1 O43613 3/20 0.52
POLB P06746 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
MAPT P10636 2/20 0.48
GAA P10253 2/20 0.48
KDM4E B2RXH2 1/20 0.48
HTT P42858 1/20 0.48
LMNA P02545 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HPGD P15428 1/20 0.48
CPT1A P50416 1/20 0.47
CPT1B Q92523 1/20 0.47
ALPL P05186 4/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
ALOX12 P18054 1/20 0.46

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
SCHEMBL23846619 0.92 ALPL (0.52) ABL1HCRTR2HCRTR1POLBCYP1A2
SCHEMBL23846349 0.90 ALPL (0.46) ABL1HCRTR2HCRTR1GAALMNA
SCHEMBL23846386 0.87 MEN1 (0.55) ABL1HCRTR2HCRTR1POLBCYP1A2
SCHEMBL23846331 0.86 IMPDH2 (0.53) HCRTR2HCRTR1POLBMAPTGAA
SCHEMBL23846480 0.85 GRM4 (0.51) HCRTR2HCRTR1POLBCYP1A2CYP3A4
SCHEMBL25758295 0.83 MAPT (0.52) HCRTR2HCRTR1POLBCYP1A2CYP3A4
SCHEMBL23846564 0.83 HCRTR1 (0.50) HCRTR2HCRTR1POLBMAPTGAA
SCHEMBL25755382 0.83 MAPT (0.52) HCRTR2HCRTR1POLBMAPTGAA
SCHEMBL25758282 0.82 HTR2A (0.48) HCRTR2HCRTR1POLBCYP1A2CYP3A4
SCHEMBL23846519 0.81 HCRTR2 (0.61) HCRTR2HCRTR1POLBMAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174523-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF AMATHUS THERAPEUTICS, INC. (US) 2023-06-08 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-20230174523-A1 BENZENESULFONAMIDE DERIVATIVES AS TRAP1 MODULATORS AND USES THEREOF TRAP1, PINK1, TP53BP1 ABL1 1740/4885HCRTR2 4205/4885HCRTR1 3597/4885

“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.