SCHEMBL6097914

SCHEMBL6097914

O=S(=O)(c1cccc2ccccc12)C1CCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA9 Q16790 1/20 0.52
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
COMT P21964 1/20 0.46
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
CNR1 P21554 4/20 0.44
HTR6 P50406 3/20 0.44
F2 P00734 2/20 0.44
PRSS1 P07477 2/20 0.44
PRSS2 P07478 2/20 0.44
PRSS3 P35030 2/20 0.44
TSHR P16473 1/20 0.42
LOXL2 Q9Y4K0 2/20 0.41
EPHX2 P34913 1/20 0.41
MAOA P21397 1/20 0.41
LOX P28300 1/20 0.41
NPY5R Q15761 1/20 0.40

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
SCHEMBL3240747 0.95 MEN1 (0.53) CA1CA2CA9MEN1KMT2A
SCHEMBL20789878 0.93 CA1 (0.55) CA1CA2CA9MEN1KMT2A
SCHEMBL8484443 0.85 HTR6 (0.50) CA1CA2CA9HTR6
SCHEMBL10794598 0.83 HTR6 (0.54) CA1CA2CA9HTR6
Hydrochloric Acid SCHEMBL10795401 0.82 HTR6 (0.53) CA1CA2CA9HTR6
SCHEMBL19308201 0.79 CA1 (0.45) CA1CA2CA9MEN1KMT2A
SCHEMBL335090 0.74 CA1 (0.44) CA1CA2CA9MEN1KMT2A
SCHEMBL15916586 0.74 MAPT (0.53) CA1CA2COMTHTR6EPHX2
SCHEMBL294005 0.73 CA1 (0.46) CA1CA2CA9MEN1KMT2A
SCHEMBL20478805 0.72 KDM4E (0.45) CA1CA2CA9MEN1KMT2A

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-7101892-B2 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. 2006-09-05 US disclosed
US-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. (GB) 2004-11-18 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-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands HTR7, HTR2C, HTR1A CA1 2680/4885CA2 2094/4885CA9 4488/4885

“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.