SCHEMBL4071303

SCHEMBL4071303

Cc1ccc2c(S(=O)(=O)c3ccccc3)nn(CC3CCNC3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.45
KHK P50053 9/20 0.42
TDO2 P48775 2/20 0.37
SYK P43405 1/20 0.37
CHRM3 P20309 1/20 0.37
TP53 P04637 2/20 0.35
MAPT P10636 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL4069379 0.94 HTR6 (0.48) HTR6KHKTP53MAPTSMN1; SMN2
SCHEMBL4075648 0.88 HTR6 (0.42) HTR6KHKTDO2SYK
SCHEMBL4818155 0.83 HTR6 (0.41) HTR6KHKTDO2CHRM3
SCHEMBL27630666 0.82 HTR6 (0.41) HTR6KHKSYK
SCHEMBL4070719 0.82 SYK (0.44) HTR6KHKSYK
SCHEMBL4074381 0.82 HTR6 (0.46) HTR6
SCHEMBL4073460 0.82 HTR6 (0.46) HTR6TP53MAPT
SCHEMBL4073972 0.81 HTR6 (0.46) HTR6KHKMAPT
SCHEMBL4074471 0.79 HTR6 (0.51) HTR6
SCHEMBL4066407 0.76 HTR6 (0.54) HTR6TP53MAPT

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-7589108-B2 1-Heterocyclylalkyl-3-sulfonylindole or -indazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2009-09-15 US disclosed
US-20060030593-A1 1-Heterocyclylalkyl-3-sulfonylindole or -indazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2006-02-09 US disclosed
US-6995176-B2 1-heterocyclylalkyl-3-sulfonyl-indole or -indazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2006-02-07 US disclosed
US-20040024023-A1 1-Heterocyclylalkyl-3-sulfonyl-indole or -indazole derivatives as 5-hydroxytryptamine-6 ligands WYETH 2004-02-05 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 (2 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-20060030593-A1 1-Heterocyclylalkyl-3-sulfonylindole or -indazole derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR3A, HTR5A HTR6 1/4885KHK 3604/4885TDO2 382/4885
US-20040024023-A1 1-Heterocyclylalkyl-3-sulfonyl-indole or -indazole derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR3A, HTR1A HTR6 1/4885KHK 3160/4885TDO2 280/4885

“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.