SCHEMBL3536708

SCHEMBL3536708

O=S(=O)(c1cccc2ccccc12)c1n[nH]c2ccc(CCCN3CCCC3)cc12

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 15/20 0.48
TERT O14746 2/20 0.44
DRD2 P14416 4/20 0.40
HTR1A P08908 2/20 0.40
HTR2A P28223 2/20 0.40
HTR7 P34969 2/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
DRD1 P21728 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39

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
SCHEMBL3531542 0.97 HTR6 (0.46) HTR6TERTDRD2HTR1AHTR2A
SCHEMBL3529257 0.85 FGFR1 (0.52) HTR6DRD2HTR1AHTR2AHTR7
SCHEMBL3531868 0.84 FGFR1 (0.51) HTR6DRD2HTR1AHTR2AHTR7
Hydrochloric Acid SCHEMBL3531367 0.84 FGFR1 (0.51) HTR6DRD2HTR1AHTR2A
SCHEMBL3534238 0.84 HRH3 (0.51) HTR6DRD2HTR1AHTR2AHTR7
SCHEMBL3532330 0.84 HTR6 (0.45) HTR6HTR2CHTR2B
SCHEMBL3529481 0.84 HTR6 (0.52) HTR6HTR2CHTR2B
Hydrochloric Acid SCHEMBL3537925 0.83 FGFR1 (0.51) HTR6DRD2HTR1AHTR2AHTR7
SCHEMBL3532250 0.83 HRH3 (0.53) HTR6DRD2HTR1AHTR2AHTR7
SCHEMBL3530149 0.83 HTR6 (0.44) HTR6HTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-7723329-B2 Substituted-3-sulfonylindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH LLC (US) 2010-05-25 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 1/4885TERT 3918/4885DRD2 117/4885

“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.