SCHEMBL5380896

SCHEMBL5380896

Cc1ccc(S(=O)(=O)N(C)[C@@H]2CC[C@H](N3CCC(C)CC3)C2)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 12/20 0.56
▸ HTR2C P28335 12/20 0.56
▸ EBP Q15125 1/20 0.51
▸ DHCR7 Q9UBM7 1/20 0.51
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ NPSR1 Q6W5P4 1/20 0.47
▸ MCOLN3 Q8TDD5 1/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ GAA P10253 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL5380900 1.00 HTR2A (0.56) HTR2AHTR2CEBPDHCR7CYP3A4
SCHEMBL5380893 1.00 HTR2A (0.56) HTR2AHTR2CEBPDHCR7CYP3A4
Hydrochloric Acid SCHEMBL5379273 0.99 HTR2A (0.55) HTR2AHTR2CEBPDHCR7CYP3A4
Hydrochloric Acid SCHEMBL5379281 0.99 HTR2A (0.55) HTR2AHTR2CEBPDHCR7CYP3A4
Hydrochloric Acid SCHEMBL5379269 0.99 HTR2A (0.55) HTR2AHTR2CEBPDHCR7CYP3A4
SCHEMBL5419262 0.89 HTR2A (0.57) HTR2AHTR2CL3MBTL1ALDH1A1GAA
SCHEMBL5419273 0.89 HTR2A (0.57) HTR2AHTR2CL3MBTL1ALDH1A1GAA
SCHEMBL5419259 0.89 HTR2A (0.57) HTR2AHTR2CL3MBTL1ALDH1A1GAA
SCHEMBL5379282 0.89 HTR2A (0.56) HTR2AHTR2CL3MBTL1ALDH1A1GAA
SCHEMBL5379277 0.89 HTR2A (0.56) HTR2AHTR2CL3MBTL1ALDH1A1GAA

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-7276607-B2 5-HT7 receptor antagonists MERCK SHARP & DOHME LIMITED (GB) 2007-10-02 — — US claimed
US-20050080077-A1 5-ht7 receptor antagonists MERCK SHARP & DOHME LTD. (GB) 2005-04-14 — — US claimed

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-20050080077-A1 5-ht7 receptor antagonists HTR7, HTR2B, HTR1A HTR2A 13/4885HTR2C 4/4885EBP 3013/4885

“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.

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