SCHEMBL1012441

SCHEMBL1012441

CC(C)(C)OC(=O)N1CCC(c2ccc(Sc3cccc(F)c3)cc2O)C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.45
GPR119 Q8TDV5 4/20 0.44
MGLL Q99685 1/20 0.43
HPGDS O60760 1/20 0.43
PDE4B Q07343 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
LMNA P02545 1/20 0.41
BRD3 Q15059 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 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
SCHEMBL1012440 1.00 TP53 (0.45) TP53GPR119MGLLHPGDSPDE4B
SCHEMBL13230102 0.85 TP53 (0.48) TP53GPR119SMN1; SMN2LMNAKDM4E
SCHEMBL1015101 0.82 SFRP1 (0.46) TP53GPR119PDE4B
SCHEMBL1015103 0.82 SFRP1 (0.46) TP53GPR119PDE4B
SCHEMBL3547383 0.80 SMN1; SMN2 (0.53) TP53GPR119SMN1; SMN2LMNAKDM4E
SCHEMBL2473362 0.80 PDE4B (0.50) GPR119HPGDSPDE4BKDM4EMAPT
SCHEMBL2229006 0.79 GPR119 (0.42) TP53GPR119MGLLHPGDS
SCHEMBL19404908 0.79 SMN1; SMN2 (0.54) TP53GPR119PDE4BSMN1; SMN2BRD3
SCHEMBL31158869 0.79 PDE4B (0.57) TP53GPR119HPGDSPDE4BSMN1; SMN2
SCHEMBL20531395 0.79 PDE4B (0.57) TP53GPR119HPGDSPDE4BSMN1; SMN2

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 TP53 4375/4885GPR119 138/4885MGLL 2699/4885

“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.