SCHEMBL4895697

SCHEMBL4895697

Cc1nn(C)c(C)c1S(=O)(=O)F

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
ALDH1A1 P00352 4/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PROKR1 Q8TCW9 10/20 0.40
FPR2 P25090 9/20 0.40
MAPT P10636 1/20 0.39
CHRM5 P08912 1/20 0.39
NMT1 P30419 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL8232738 0.80 TSHR (0.45) TSHRALDH1A1NPSR1PROKR1FPR2
SCHEMBL4636620 0.79 MCL1 (0.48) PROKR1FPR2NMT1GAA
SCHEMBL347771 0.78 TSHR (0.44) TSHRALDH1A1NPSR1PROKR1FPR2
SCHEMBL3376273 0.78 TSHR (0.44) TSHRALDH1A1NPSR1PROKR1FPR2
SCHEMBL3069717 0.78 KDM4E (0.53) TSHRALDH1A1NPSR1PROKR1FPR2
Hydrochloric Acid SCHEMBL14759214 0.77 KDM4E (0.51) TSHRALDH1A1NPSR1PROKR1FPR2
SCHEMBL14468543 0.77 ALDH1A1 (0.48) TSHRALDH1A1NPSR1PROKR1FPR2
SCHEMBL14149159 0.75 TSHR (0.53) TSHRALDH1A1NPSR1PROKR1FPR2
SCHEMBL13726542 0.75 TSHR (0.42) TSHRALDH1A1NPSR1PROKR1FPR2
SCHEMBL13290812 0.75 ALDH1A1 (0.43) TSHRALDH1A1NPSR1PROKR1FPR2

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-20080318933-A1 5-Sulfonyl-1-Piperidinyl Substituted Indole Derivatives as 5-Ht6 Receptor Antagonists for the Treatment of Cns Disorders GLAXO GROUP LIMITED 2008-12-25 US disclosed
CN-101072768-A 5-sulfonyl-1-piperidinyl substituted indole derivatives as 5-ht6 receptor antagonists for the treatment of CNS disorders GLAXO GROUP LTD (GB) 2007-11-14 CN disclosed
EP-1814873-A2 5-SULFONYL-1-PIPERIDINYL SUBSTITUTED INDOLE DERIVATIVES AS 5-HT6 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS GLAXO GROUP LIMITED (GB) 2007-08-08 EP disclosed
WO-2006038006-A2 5-SULFONYL-1-PIPERIDINYL SUBSTITUTED INDOLE DERIVATIVES AS 5-HT6 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS GLAXO GROUP LIMITED (GB) 2006-04-13 WO 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-20080318933-A1 5-Sulfonyl-1-Piperidinyl Substituted Indole Derivatives as 5-Ht6 Receptor Antagonists for the Treatment of Cns Disorders HTR6, HTR5A, TPH1 TSHR 246/4885ALDH1A1 1462/4885NPSR1 22/4885

“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.