SCHEMBL1015211

SCHEMBL1015211

COc1cc(S(=O)(=O)c2ccccc2C#N)ccc1C1CCN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.46
TGFBR1 P36897 1/20 0.42
SCN9A Q15858 1/20 0.41
GPR119 Q8TDV5 5/20 0.41
ALOX12 P18054 1/20 0.41
PKM P14618 1/20 0.40
STS P08842 2/20 0.40
APLNR P35414 3/20 0.40
SFRP1 Q8N474 2/20 0.40
RET P07949 1/20 0.40

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
SCHEMBL1012808 0.82 PDE4B (0.51) PDE4BTGFBR1GPR119ALOX12STS
SCHEMBL1015948 0.82 STS (0.55) PDE4BTGFBR1GPR119ALOX12STS
SCHEMBL1012382 0.82 PDE4B (0.51) PDE4BTGFBR1GPR119ALOX12STS
SCHEMBL1012384 0.82 PDE4B (0.51) PDE4BTGFBR1GPR119ALOX12STS
SCHEMBL1014751 0.82 PDE4B (0.45) PDE4BSCN9AGPR119RET
SCHEMBL1013426 0.82 PDE4B (0.47) PDE4BGPR119RET
SCHEMBL19404952 0.80 GPR119 (0.53) PDE4BGPR119RET
SCHEMBL20140722 0.80 GPR119 (0.53) PDE4BGPR119RET
SCHEMBL13230559 0.79 PDE4B (0.45) PDE4BTGFBR1SCN9AGPR119ALOX12
SCHEMBL1014623 0.79 PDE4B (0.47) PDE4BTGFBR1GPR119ALOX12STS

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
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
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
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
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 PDE4B 1026/4885TGFBR1 3794/4885SCN9A 1691/4885

“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.