SCHEMBL8239684

SCHEMBL8239684

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

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.56
DRD2 P14416 2/20 0.53
HTR2C P28335 2/20 0.53
HTR2B P41595 2/20 0.53
CPT1A P50416 4/20 0.47
CPT1B Q92523 3/20 0.47
PTGER4 P35408 4/20 0.47
MAPK10 P53779 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
SCHEMBL3530833 0.89 HTR6 (0.59) HTR6DRD2HTR2CHTR2BCPT1A
SCHEMBL3532667 0.81 HTR6 (0.57) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3532651 0.81 HTR6 (0.53) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3532494 0.79 HTR6 (0.52) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3589873 0.79 HTR6 (0.53) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3531338 0.79 HTR6 (0.53) HTR6DRD2HTR2CHTR2B
SCHEMBL3529115 0.79 HTR6 (0.51) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3532673 0.79 HTR6 (0.53) HTR6DRD2HTR2CHTR2BPTGER4
SCHEMBL3948495 0.79 HTR6 (0.88) HTR6DRD2HTR2CHTR2B
SCHEMBL3532291 0.78 HTR6 (0.53) HTR6DRD2HTR2CHTR2BPTGER4

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 5 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
US-7723329-B2 Substituted-3-sulfonylindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH LLC (US) 2010-05-25 US 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
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.