SCHEMBL3530833

SCHEMBL3530833

O=C(O)c1ccc2c(c1)c(S(=O)(=O)c1cccc3ccccc13)nn2Cc1cccc(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.59
DRD2 P14416 2/20 0.59
HTR2C P28335 2/20 0.59
HTR2B P41595 2/20 0.59
PTGER4 P35408 6/20 0.54
CPT1A P50416 2/20 0.44
CPT1B Q92523 2/20 0.44
HCAR3 P49019 1/20 0.43
CCR2 P41597 1/20 0.42
PLA2G2A P14555 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
SCHEMBL8239684 0.89 HTR6 (0.56) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3532667 0.84 HTR6 (0.57) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3532495 0.81 HTR6 (0.52) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3589873 0.80 HTR6 (0.53) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3948495 0.80 HTR6 (0.88) HTR6DRD2HTR2CHTR2B
SCHEMBL7992121 0.80 HTR6 (0.88) HTR6DRD2HTR2CHTR2B
SCHEMBL3532673 0.80 HTR6 (0.53) HTR6DRD2HTR2CHTR2BPTGER4
Hydrochloric Acid SCHEMBL4278516 0.79 HTR6 (0.87) HTR6DRD2HTR2CHTR2B
SCHEMBL3532651 0.78 HTR6 (0.53) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3531338 0.78 HTR6 (0.53) HTR6DRD2HTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723329-B2 Substituted-3-sulfonylindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH LLC (US) 2010-05-25 US disclosed
EP-1931640-A2 SUBSTITUTED-3-SULFONYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth a Corporation of the State of Delaware (US) 2008-06-18 EP disclosed
WO-2007021711-A2 SUBSTITUTED-3-SULFONYLINDAZOLE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2007-02-22 WO disclosed
US-20070037802-A1 such as N,N-Dimethyl-3-{[3-(1-naphthylsulfonyl)-1H-indazol-5-yl]oxy}propan-1-amine, used for the treatment of a central nervous system disorders WYETH (US) 2007-02-15 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-20070037802-A1 such as N,N-Dimethyl-3-{[3-(1-naphthylsulfonyl)-1H-indazol-5-yl]oxy}propan-1-amine, used for the treatment of a central nervous system disorders HTR6, TPH1, HTR1A HTR6 1/4885DRD2 117/4885HTR2C 7/4885

“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.