SCHEMBL1016155

SCHEMBL1016155

CC(C)(C)OC(=O)N1CCC(c2ccc(S(=O)(=O)c3ccc(O)cc3)cc2)C1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.53
GPR119 Q8TDV5 9/20 0.52
NAMPT P43490 1/20 0.47
STS P08842 3/20 0.46
TGFBR1 P36897 1/20 0.45
SFRP1 Q8N474 2/20 0.44
MMP1 P03956 1/20 0.43
MMP9 P14780 1/20 0.43
MMP13 P45452 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL1016154 1.00 PDE4B (0.53) PDE4BGPR119NAMPTSTSTGFBR1
SCHEMBL18937651 0.92 PDE4B (0.60) PDE4BGPR119NAMPTKDM4EMAPT
SCHEMBL20748135 0.85 PDE4B (0.53) PDE4BGPR119NAMPTMAPT
SCHEMBL28301552 0.85 PDE4B (0.53) PDE4BGPR119NAMPTMAPT
SCHEMBL1015081 0.84 PDE4B (0.47) PDE4BGPR119NAMPTSTSMMP1
SCHEMBL1015080 0.84 PDE4B (0.47) PDE4BGPR119NAMPTSTSMMP1
SCHEMBL3854559 0.84 NAMPT (0.61) PDE4BGPR119NAMPTSTSKDM4E
SCHEMBL12321142 0.81 PDE4B (0.60) PDE4BGPR119NAMPTKDM4EMAPT
SCHEMBL17530337 0.81 GPR119 (0.62) PDE4BGPR119
SCHEMBL20607546 0.81 RORC (0.48) PDE4BGPR119NAMPTKDM4E

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 3 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-20080167361-A1 Arylsulfonyl pyrrolidines as 5-HT6 inhibitors ROCHE PALO ALTO LLC 2008-07-10 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 (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 1026/4885GPR119 138/4885NAMPT 1558/4885

“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.