SCHEMBL1015255

SCHEMBL1015255

CN1CCC(c2ccc(S(=O)(=O)c3ccc(O)cc3)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
QDPR P09417 1/20 0.42
APOBEC3A P31941 1/20 0.42
APOBEC3G Q9HC16 1/20 0.42
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
ESR2 Q92731 2/20 0.41
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KCNH2 Q12809 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
HTR6 P50406 1/20 0.39
BRD4 O60885 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
SCHEMBL1015252 1.00 QDPR (0.42) QDPRAPOBEC3AAPOBEC3GGAAPKM
Hydrochloric Acid SCHEMBL1016144 0.99 APOBEC3A (0.44) QDPRAPOBEC3AAPOBEC3GGAAPKM
Hydrochloric Acid SCHEMBL1016145 0.99 APOBEC3A (0.44) QDPRAPOBEC3AAPOBEC3GGAAPKM
SCHEMBL1014142 0.83 HTR6 (0.41) HTR6
SCHEMBL1014141 0.83 HTR6 (0.41) HTR6
SCHEMBL13211000 0.82 GAA (0.39) GAAPKMESR2LMNAHTT
SCHEMBL1013448 0.81 RAPGEF4 (0.40) HTR6
SCHEMBL1013449 0.81 RAPGEF4 (0.40) HTR6
SCHEMBL1014814 0.80 HTR6 (0.43) HTR6
SCHEMBL1015838 0.80 HTR6 (0.43) HTR6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2081890-B1 ARYLSULFONYL PYRROLIDINES AS 5-HT6 INHIBITORS HOFFMANN LA ROCHE (CH) 2011-01-12 EP claimed
EP-2081890-B1 ARYLSULFONYL PYRROLIDINES AS 5-HT6 INHIBITORS HOFFMANN LA ROCHE (CH) 2011-01-12 EP disclosed
US-7776910-B2 Arylsulfonyl pyrrolidines as 5-HT6 inhibitors ROCHE PALO ALTO LLC (US) 2010-08-17 US disclosed
EP-2081890-A1 ARYLSULFONYL PYRROLIDINES AS 5-HT6 INHIBITORS F. Hoffmann-Roche AG (CH) 2009-07-29 EP disclosed
US-20080167361-A1 Arylsulfonyl pyrrolidines as 5-HT6 inhibitors ROCHE PALO ALTO LLC 2008-07-10 US disclosed
WO-2008055847-A1 ARYLSULFONYL PYRROLIDINES AS 5-HT6 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2008-05-15 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-20080167361-A1 Arylsulfonyl pyrrolidines as 5-HT6 inhibitors HTR6, HTR1B, HTR1F QDPR 124/4885APOBEC3A 4426/4885APOBEC3G 4473/4885

“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.