SCHEMBL3532250

SCHEMBL3532250

O=S(=O)(c1cccc2ccccc12)c1n[nH]c2ccc(OCCCCN3CCCCC3)cc12

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.53
HTR6 P50406 4/20 0.49
HTR2A P28223 3/20 0.49
HTR7 P34969 2/20 0.49
FGFR1 P11362 1/20 0.49
FLT1 P17948 1/20 0.49
MAOB P27338 4/20 0.48
BCHE P06276 1/20 0.48
ACHE P22303 1/20 0.48
HTR1A P08908 1/20 0.47
DRD2 P14416 1/20 0.47
KCNH2 Q12809 1/20 0.47
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL3534238 0.99 HRH3 (0.51) HRH3HTR6HTR2AHTR7FGFR1
SCHEMBL3531868 0.97 FGFR1 (0.51) HRH3HTR6HTR2AHTR7FGFR1
Hydrochloric Acid SCHEMBL3537925 0.96 FGFR1 (0.51) HRH3HTR6HTR2AHTR7FGFR1
SCHEMBL3529257 0.96 FGFR1 (0.52) HRH3HTR6HTR2AHTR7FGFR1
Hydrochloric Acid SCHEMBL3531367 0.95 FGFR1 (0.51) HRH3HTR6HTR2AFGFR1FLT1
SCHEMBL3531937 0.95 PDGFRB (0.47) HRH3HTR6FGFR1FLT1
Hydrochloric Acid SCHEMBL3530919 0.94 HTR6 (0.47) HRH3HTR6FGFR1FLT1
SCHEMBL3532273 0.94 HTR6 (0.47) HRH3HTR6FGFR1FLT1
Hydrochloric Acid SCHEMBL3540594 0.93 HTR6 (0.47) HRH3HTR6FGFR1FLT1
SCHEMBL3534479 0.89 HTR6 (0.47) HRH3HTR6HTR2AFGFR1FLT1

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 8 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-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
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 HRH3 534/4885HTR6 1/4885HTR2A 11/4885

“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.