SCHEMBL6098656

SCHEMBL6098656

O=S(=O)(c1ccccc1)C1(CCCN2CC=C(c3ccc(Cl)cc3)CC2)CCC1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 11/20 0.60
HTR1A P08908 4/20 0.60
HTR2A P28223 2/20 0.60
SIGMAR1 Q99720 5/20 0.55
PARP1 P09874 1/20 0.47

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
SCHEMBL6097503 0.90 HTR7 (0.60) HTR7HTR1AHTR2ASIGMAR1PARP1
SCHEMBL6097629 0.75 HTR7 (1.00) HTR7HTR1AHTR2A
SCHEMBL9375288 0.73 SIGMAR1 (0.92) HTR1ASIGMAR1PARP1
SCHEMBL918431 0.72 SIGMAR1 (0.60) HTR1ASIGMAR1PARP1
SCHEMBL9377531 0.72 SIGMAR1 (1.00) HTR1ASIGMAR1PARP1
SCHEMBL6096649 0.70 HTR7 (0.68) HTR7HTR1AHTR2ASIGMAR1
SCHEMBL6100289 0.70 HTR7 (0.91) HTR7HTR1AHTR2A
SCHEMBL6099006 0.70 HTR7 (1.00) HTR7HTR1AHTR2ASIGMAR1
SCHEMBL6626009 0.70 SIGMAR1 (0.65) HTR7HTR1ASIGMAR1PARP1
SCHEMBL11938943 0.70 SIGMAR1 (0.65) HTR7HTR1ASIGMAR1

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-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. (GB) 2004-11-18 US claimed
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 HTR7 1/4885HTR1A 3/4885HTR2A 12/4885

“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.