SCHEMBL25256077

SCHEMBL25256077

Cc1cc(Br)ccc1S(=O)(=O)CC1CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
HCRTR1 O43613 1/20 0.40
HCRTR2 O43614 1/20 0.40
BRD4 O60885 1/20 0.37
BRD1 O95696 1/20 0.37
BRPF1 P55201 1/20 0.37
BRPF3 Q9ULD4 1/20 0.37
EPHX2 P34913 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP7 P09237 1/20 0.36
MMP13 P45452 1/20 0.36
PLCG1 P19174 1/20 0.35
GHSR Q92847 1/20 0.34
PIK3C3 Q8NEB9 1/20 0.34
LMNA P02545 3/20 0.33
HTT P42858 2/20 0.33
RECQL P46063 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
SCHEMBL2409974 0.81 AOC2 (0.42) CA1CA2HCRTR1HCRTR2PLCG1
SCHEMBL14478110 0.79 CA1 (0.51) CA1CA2HCRTR1HCRTR2BRD4
SCHEMBL25426349 0.79 LPL (0.34) CA1CA2MMP1MMP2MMP3
SCHEMBL16852266 0.78 EPHX2 (0.38) EPHX2PIK3C3LMNAHTTSMN1; SMN2
SCHEMBL25426324 0.78 CA1 (0.35) CA1CA2
SCHEMBL21761090 0.77 SMN1; SMN2 (0.54) HTTSMN1; SMN2
SCHEMBL30291967 0.76 JAK2 (0.44) HTTALOX5APFEN1
SCHEMBL25258150 0.75 CA1 (0.44) CA1CA2HCRTR1HCRTR2BRD4
SCHEMBL28999306 0.75 CA1 (0.48) CA1CA2HCRTR1HCRTR2BRD4
SCHEMBL30291972 0.74 PLCG1 (0.41) CA1CA2PLCG1PIK3C3F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12565497-B2 Sulfone derivatives HOFFMANN-LA ROCHE INC. (US) 2026-03-03 US disclosed
US-20230219953-A1 SULFONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-07-13 US disclosed
CN-115916756-A Sulfone derivative 豪夫迈·罗氏有限公司 2023-04-04 CN 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 (2 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-20230219953-A1 SULFONE DERIVATIVES SULT1E1, SULT1A1, SULT2A1 CA1 1905/4885CA2 828/4885HCRTR1 1965/4885
US-12565497-B2 Sulfone derivatives CXCR1, CCR1, SULT1E1 CA1 406/4885CA2 236/4885HCRTR1 281/4885

“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.