SCHEMBL4217445

SCHEMBL4217445

CN1CCC(c2n[nH]c3ccc(S(=O)(=O)c4ccc5ccccc5c4)cc23)CC1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 13/20 0.68
HTR2B P41595 1/20 0.43
AKR1B1 P15121 1/20 0.43
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
HTT P42858 2/20 0.42
KMT2A Q03164 2/20 0.42
USP2 O75604 1/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PKM P14618 1/20 0.41

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
SCHEMBL4212716 0.90 HTR6 (0.66) HTR6HTR2B
SCHEMBL4201696 0.87 HTR6 (0.69) HTR6HTR2B
SCHEMBL3320144 0.86 HTR6 (0.53) HTR6KMT2APKM
Hydrochloric Acid SCHEMBL4204164 0.86 HTR6 (0.68) HTR6HTR2B
SCHEMBL4214353 0.85 HTR6 (0.68) HTR6
SCHEMBL4206341 0.85 HTR6 (0.67) HTR6
SCHEMBL4209627 0.84 HTR6 (0.68) HTR6HTR2BAKR1B1LMNAHTT
SCHEMBL4211456 0.84 HTR6 (0.68) HTR6
SCHEMBL4217325 0.84 HTR6 (0.51) HTR6MEN1MAPTKMT2ATSHR
SCHEMBL30909133 0.83 DYRK1A (0.48) 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7482461-B2 Sulfonyl-3-heterocyclylindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2009-01-27 US claimed
EP-2001865-A1 SULFONYL-3-HETEROCYCLYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth a Corporation of the State of Delaware (US) 2008-12-17 EP claimed
WO-2007117413-A1 SULFONYL-3-HETEROCYCLYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2007-10-18 WO claimed
US-20070238724-A1 Sulfonyl-3-heterocyclylindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-10-11 US claimed
US-20090105303-A1 SULFONYL-3-HETEROCYCLYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2009-04-23 US disclosed
US-7482461-B2 Sulfonyl-3-heterocyclylindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2009-01-27 US disclosed
EP-2001865-A1 SULFONYL-3-HETEROCYCLYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth a Corporation of the State of Delaware (US) 2008-12-17 EP disclosed
WO-2007117413-A1 SULFONYL-3-HETEROCYCLYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2007-10-18 WO disclosed
US-20070238724-A1 Sulfonyl-3-heterocyclylindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-10-11 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 (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-20070238724-A1 Sulfonyl-3-heterocyclylindazole derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR2C, HTR3B HTR6 1/4885HTR2B 13/4885AKR1B1 2298/4885
US-20090105303-A1 SULFONYL-3-HETEROCYCLYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS HTR6, HTR2C, HTR3B HTR6 1/4885HTR2B 13/4885AKR1B1 2298/4885

“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.