SCHEMBL1156258

SCHEMBL1156258

CC(C)(C)OC(=O)N1CCC(C(=O)c2ccccc2)C1=O

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
GPR119 Q8TDV5 2/20 0.46
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
STS P08842 1/20 0.45
KDM1A O60341 1/20 0.44
MCL1 Q07820 1/20 0.42
USP30 Q70CQ3 3/20 0.41
CCR8 P51685 1/20 0.41

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
SCHEMBL28914879 0.83 PDE4A (0.46) KDM4EGPR119PDE4APDE4BPDE4C
SCHEMBL28586371 0.83 PDE4A (0.46) KDM4EGPR119PDE4APDE4BPDE4C
SCHEMBL25292925 0.80 MEN1 (0.47) MEN1KMT2ASTS
SCHEMBL20594536 0.80 PDE4A (0.46) KDM4EGPR119PDE4APDE4BPDE4C
SCHEMBL16097475 0.80 FPR2 (0.43) GPR119PDE4APDE4BPDE4CPDE4D
SCHEMBL3733957 0.80 KDM4E (0.52) KDM4EPKMGPR119MEN1KMT2A
SCHEMBL3730368 0.80 PDE4A (0.57) KDM4EPKMGPR119PDE4APDE4B
SCHEMBL1828425 0.79 MCL1 (0.47) MEN1KMT2AMCL1
SCHEMBL27504767 0.79 STS (0.48) KDM4EPKMGPR119STS
SCHEMBL3741416 0.79 STS (0.48) KDM4EPKMGPR119STS

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8933249-B2 3-(phenoxyphenylmethyl)pyrrolidine compounds THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-01-13 US disclosed
US-8933249-B2 3-(phenoxyphenylmethyl)pyrrolidine compounds THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-01-13 US disclosed
US-8933249-B2 3-(phenoxyphenylmethyl)pyrrolidine compounds THERAVANCE BIOPHARMA R&D IP, LLC (US) 2015-01-13 US disclosed
EP-2318362-B1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE INC (US) 2013-09-25 EP disclosed
EP-2318362-B1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE INC (US) 2013-09-25 EP disclosed
US-20130178509-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE, INC. (US) 2013-07-11 US disclosed
US-20130178509-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE, INC. (US) 2013-07-11 US disclosed
US-20130178509-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE, INC. (US) 2013-07-11 US disclosed
US-8242164-B2 3-(phenoxyphenylmethyl)pyrrolidine compounds THERAVANCE, INC. (US) 2012-08-14 US disclosed
US-8242164-B2 3-(phenoxyphenylmethyl)pyrrolidine compounds THERAVANCE, INC. (US) 2012-08-14 US disclosed
US-20110275694-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE, INC. (US) 2011-11-10 US disclosed
EP-2318362-A2 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS Theravance, Inc. (US) 2011-05-11 EP disclosed
US-7888386-B2 3-(phenoxyphenylmethyl)pyrrolidine compounds THERAVANCE, INC. (US) 2011-02-15 US disclosed
US-7888386-B2 3-(phenoxyphenylmethyl)pyrrolidine compounds THERAVANCE, INC. (US) 2011-02-15 US disclosed
US-7888386-B2 3-(phenoxyphenylmethyl)pyrrolidine compounds THERAVANCE, INC. (US) 2011-02-15 US disclosed
WO-2010011811-A2 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE, INC. (US) 2010-01-28 WO disclosed
WO-2010011811-A2 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE, INC. (US) 2010-01-28 WO disclosed
US-20100022616-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE BIOPHARMA R&D IP, LLC 2010-01-28 US disclosed
US-20100022616-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE BIOPHARMA R&D IP, LLC 2010-01-28 US disclosed
US-20100022616-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS THERAVANCE BIOPHARMA R&D IP, LLC 2010-01-28 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 (3 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-20130178509-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS HTR6, SLC6A2, SLC6A4 KDM4E 667/4885PKM 394/4885GPR119 1182/4885
US-20110275694-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS HTR6, SLC6A2, SLC6A4 KDM4E 667/4885PKM 394/4885GPR119 1182/4885
US-20100022616-A1 3-(PHENOXYPHENYLMETHYL)PYRROLIDINE COMPOUNDS HTR6, SLC6A2, SLC6A4 KDM4E 667/4885PKM 394/4885GPR119 1182/4885

“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.