SCHEMBL6548285

SCHEMBL6548285

C[C@@H]1CN(c2ccc(S(=O)(=O)c3ccccc3)c3ccccc23)C[C@H](C)N1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 11/20 0.62
GHSR Q92847 8/20 0.41
GRM5 P41594 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
SCHEMBL6549721 1.00 HTR6 (0.62) HTR6GHSRGRM5
SCHEMBL3613058 0.84 GHSR (0.43) HTR6GHSR
SCHEMBL3613062 0.84 GHSR (0.43) HTR6GHSR
SCHEMBL6548713 0.77 HTR6 (0.71) HTR6
SCHEMBL3323330 0.77 HTR6 (1.00) HTR6
SCHEMBL4312655 0.76 GHSR (0.56) GHSR
SCHEMBL4676469 0.74 HTR6 (0.66) HTR6GHSR
SCHEMBL6047105 0.73 GHSR (0.64) GHSR
SCHEMBL1381340 0.73 GHSR (0.49) HTR6GHSR
SCHEMBL6549576 0.73 HTR6 (0.90) HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1478361-A2 ARYLSULFONE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2004-11-24 EP claimed
US-20030220325-A1 Such as 1-(4-(phenylsulfonyl)-naphthyl)piperazine; for treating treating diseases related to 5-HT receptor; radiolabelling PHARMACIA & UPJOHN COMPANY 2003-11-27 US claimed
WO-2003072558-A2 ARYLSULFONE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-09-04 WO claimed
EP-1478361-A2 ARYLSULFONE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2004-11-24 EP disclosed
US-20030220325-A1 Such as 1-(4-(phenylsulfonyl)-naphthyl)piperazine; for treating treating diseases related to 5-HT receptor; radiolabelling PHARMACIA & UPJOHN COMPANY 2003-11-27 US disclosed
WO-2003072558-A2 ARYLSULFONE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-09-04 WO 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-20030220325-A1 Such as 1-(4-(phenylsulfonyl)-naphthyl)piperazine; for treating treating diseases related to 5-HT receptor; radiolabelling HTR6, TPH1, HTR5A HTR6 1/4885GHSR 121/4885GRM5 69/4885

“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.