SCHEMBL4070719

SCHEMBL4070719

Cc1ccc(S(=O)(=O)c2nn(CC3CCCNC3)c3ccccc23)cc1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.44
HTR6 P50406 4/20 0.41
MERTK Q12866 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KHK P50053 2/20 0.39
BRD4 O60885 1/20 0.39
SSTR4 P31391 1/20 0.39
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
CNR1 P21554 1/20 0.38
ACHE P22303 1/20 0.38
CNR2 P34972 1/20 0.38

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
SCHEMBL4075648 0.94 HTR6 (0.42) SYKHTR6ALDH1A1HPGDKDM4E
SCHEMBL4071303 0.82 HTR6 (0.45) SYKHTR6KHK
SCHEMBL4815895 0.81 HTR6 (0.42) SYKHTR6MERTKKHK
SCHEMBL27630666 0.80 HTR6 (0.41) SYKHTR6MERTKKHKCNR2
SCHEMBL4069299 0.79 HTR6 (0.54) HTR6
SCHEMBL4071908 0.78 TDO2 (0.37) SYKHTR6KHKSSTR4CNR1
SCHEMBL4069379 0.76 HTR6 (0.48) HTR6MERTKALDH1A1HPGDKDM4E
SCHEMBL4818155 0.75 HTR6 (0.41) HTR6MERTKKHK
SCHEMBL4074489 0.75 HTR6 (0.50) HTR6MERTKKMT2A
SCHEMBL4070322 0.75 HTR6 (0.50) HTR6MERTKKMT2A

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 SYK 1756/4885HTR6 1/4885MERTK 1944/4885
US-20040024023-A1 1-Heterocyclylalkyl-3-sulfonyl-indole or -indazole derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR3A, HTR1A SYK 1640/4885HTR6 1/4885MERTK 1724/4885

“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.