SCHEMBL25757044

SCHEMBL25757044

O=C(Nc1cccc(S(=O)(=O)Nc2ccc(Br)cc2)c1)c1cnc(-c2ccccc2)[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.53
KMT2A Q03164 10/20 0.53
ADORA3 P0DMS8 1/20 0.53
SLC6A3 Q01959 1/20 0.53
MAPT P10636 6/20 0.52
TP53 P04637 1/20 0.52
HTT P42858 5/20 0.49
LMNA P02545 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
ALDH1A1 P00352 2/20 0.49
ALOX12 P18054 1/20 0.49
NPSR1 Q6W5P4 2/20 0.48
MAPK1 P28482 2/20 0.47
GAA P10253 1/20 0.47
GPR27 Q9NS67 3/20 0.47
AVPR2 P30518 1/20 0.47
BRD4 O60885 1/20 0.45
HDAC2 Q92769 1/20 0.45
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45

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
SCHEMBL23846406 0.85 LMNA (0.47) MEN1KMT2AMAPTTP53HTT
SCHEMBL23846432 0.83 MAPT (0.45) MEN1KMT2AMAPTTP53HTT
SCHEMBL25755060 0.82 MEN1 (0.53) MEN1KMT2AADORA3SLC6A3MAPT
SCHEMBL20841762 0.82 MAPT (0.60) MEN1KMT2AMAPTHTTLMNA
SCHEMBL23833433 0.78 MEN1 (0.47) MEN1KMT2AMAPTHTTLMNA
SCHEMBL23846409 0.78 KMT2A (0.42) MEN1KMT2AMAPTTP53HTT
SCHEMBL25755155 0.76 KMT2A (0.57) MEN1KMT2AMAPTHTTLMNA
SCHEMBL23833444 0.76 PIN1 (0.42) MEN1KMT2AMAPTTP53LMNA
SCHEMBL25755149 0.75 KMT2A (0.56) MEN1KMT2AMAPTHTTLMNA
SCHEMBL23833381 0.74 PIN1 (0.52) MEN1KMT2AMAPTTP53HTT

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 MEN1 3902/4885KMT2A 4864/4885ADORA3 2766/4885

“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.