SCHEMBL3948917

SCHEMBL3948917

Cn1nc(S(=O)(=O)c2ccccc2)c2cc(N3CCNCC3)ccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 19/20 1.00
DRD2 P14416 4/20 0.72
HTR2C P28335 4/20 0.72
HTR2B P41595 4/20 0.72
HTR1A P08908 1/20 0.72
HTR1D P28221 1/20 0.72
HTR1B P28222 1/20 0.72
KHK P50053 1/20 0.63

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
SCHEMBL3953083 0.90 HTR6 (0.81) HTR6DRD2HTR2CHTR2BHTR1A
SCHEMBL3955847 0.86 HTR6 (0.76) HTR6DRD2HTR2CHTR2BHTR1A
SCHEMBL7993006 0.84 HTR6 (1.00) HTR6DRD2HTR2CHTR2BHTR1A
Hydrochloric Acid SCHEMBL4284254 0.83 HTR6 (0.98) HTR6DRD2HTR2CHTR2BHTR1A
SCHEMBL3957131 0.83 HTR6 (0.70) HTR6DRD2HTR2CHTR2BHTR1A
Hydrochloric Acid SCHEMBL3955866 0.80 HTR6 (0.66) HTR6DRD2HTR2CHTR2BHTR1A
SCHEMBL1136468 0.78 HTR6 (0.64) HTR6DRD2HTR2CHTR2BHTR1A
SCHEMBL3949533 0.77 HTR6 (0.62) HTR6DRD2HTR2CHTR2BHTR1A
SCHEMBL3952442 0.76 HTR6 (0.61) HTR6DRD2HTR2CHTR2BHTR1A
SCHEMBL3957575 0.74 HTR6 (0.59) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238696-B2 Heterocyclyl-3-sulfonylindazoles as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-07-03 US claimed
US-20040167122-A1 Heterocyclyl-3-sulfonylindazoles as 5-hydroxytryptamine-6 ligands WYETH 2004-08-26 US claimed
US-20090253711-A1 HETEROCYCLYL-3-SULFONYLINDAZOLES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2009-10-08 US disclosed
US-7560470-B2 Heterocyclyl-3-sulfonylindazoles as 5-hydroxytryptamine-6 ligands WYETH (US) 2009-07-14 US disclosed
US-20070232618-A1 Heterocyclyl-3-sulfonylindazoles as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-10-04 US disclosed
US-7238696-B2 Heterocyclyl-3-sulfonylindazoles as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-07-03 US disclosed
US-20040167122-A1 Heterocyclyl-3-sulfonylindazoles as 5-hydroxytryptamine-6 ligands WYETH 2004-08-26 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 (3 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-20070232618-A1 Heterocyclyl-3-sulfonylindazoles as 5-hydroxytryptamine-6 ligands HTR6, HTR2C, HTR3B HTR6 1/4885DRD2 158/4885HTR2C 2/4885
US-20090253711-A1 HETEROCYCLYL-3-SULFONYLINDAZOLES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS HTR6, HTR2C, HTR3B HTR6 1/4885DRD2 158/4885HTR2C 2/4885
US-20040167122-A1 Heterocyclyl-3-sulfonylindazoles as 5-hydroxytryptamine-6 ligands HTR6, HTR1A, HTR2C HTR6 1/4885DRD2 169/4885HTR2C 3/4885

“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.