SCHEMBL25754772

SCHEMBL25754772

Cc1ccc2c(c1)CCN2S(=O)(=O)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.55
MEN1 O00255 7/20 0.55
POLB P06746 1/20 0.55
LMNA P02545 1/20 0.53
ALDH1A1 P00352 1/20 0.52
ATM Q13315 1/20 0.51
MAPT P10636 1/20 0.50
TP53 P04637 1/20 0.48
ACHE P22303 1/20 0.48
DRD3 P35462 1/20 0.46
HTR6 P50406 1/20 0.46
CYP11B1 P15538 1/20 0.46
CYP11B2 P19099 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
SCHEMBL5474904 0.85 KMT2A (0.66) KMT2AMEN1POLBLMNAALDH1A1
SCHEMBL5478426 0.83 KMT2A (0.57) KMT2AMEN1POLBLMNAALDH1A1
SCHEMBL27295451 0.82 DRD3 (0.57) KMT2AMEN1POLBMAPTTP53
SCHEMBL25754768 0.81 ACHE (0.51) KMT2AMEN1POLBLMNAALDH1A1
SCHEMBL25754850 0.81 MEN1 (0.55) KMT2AMEN1ATMMAPTTP53
SCHEMBL5467487 0.81 VCAM1 (0.58) KMT2AMEN1POLBMAPTTP53
SCHEMBL4104412 0.79 KMT2A (0.66) KMT2AMEN1POLBLMNAALDH1A1
SCHEMBL5461095 0.78 KMT2A (0.61) KMT2AMEN1POLBLMNAALDH1A1
SCHEMBL6623873 0.77 KMT2A (0.46) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL5467408 0.77 ALDH1A1 (0.62) KMT2AMEN1POLBLMNAALDH1A1

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 2 patents. 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
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 KMT2A 4864/4885MEN1 3902/4885POLB 1494/4885

“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.