SCHEMBL6419604

SCHEMBL6419604

O=Cc1cccn1S(=O)(=O)c1ccc(F)cc1F

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPME1 Q9Y570 4/20 0.67
HTR6 P50406 6/20 0.41
PKM P14618 1/20 0.37
PKLR P30613 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
KDM2B Q8NHM5 1/20 0.35
TRIM24 O15164 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35
AKR1B1 P15121 1/20 0.35
GRM4 Q14833 1/20 0.34
RAPGEF4 Q8WZA2 1/20 0.33
PIK3C3 Q8NEB9 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33

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
SCHEMBL3968075 0.78 PPME1 (0.55) PPME1HTR6PKMTRIM24TRIM33
SCHEMBL3968076 0.71 MET (0.47) PPME1HTR6ALDH1A1TRIM24TRIM33
SCHEMBL29221130 0.71 RAPGEF4 (0.59) PPME1ALDH1A1TRIM24TRIM33RAPGEF4
SCHEMBL6420296 0.70 MEN1 (0.53) PPME1PKMALDH1A1MAPT
SCHEMBL1616366 0.69 PPME1 (0.60) PPME1HTR6ALDH1A1TRIM24TRIM33
SCHEMBL5247297 0.67 RAPGEF4 (0.60) PPME1ALDH1A1MAPTTRIM24TRIM33
SCHEMBL2460281 0.67 TRIM24 (0.52) PPME1HTR6ALDH1A1TRIM24TRIM33
SCHEMBL2464163 0.66 TRIM24 (0.42) PPME1ALDH1A1TRIM24TRIM33
SCHEMBL3964674 0.66 PPME1 (0.58) PPME1PKMALDH1A1RAPGEF4
SCHEMBL2457308 0.66 RAPGEF4 (0.58) PPME1PKMALDH1A1TRIM24TRIM33

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-6861419-B2 Substituted 1, 4-thiazepine and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2005-03-01 US disclosed
US-20020010169-A1 Substituted 1, 4-thiazepine and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2002-01-24 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-20020010169-A1 Substituted 1, 4-thiazepine and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP1, CASP14, CASP4 PPME1 693/4885HTR6 2603/4885PKM 2265/4885

“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.