SCHEMBL3993928

SCHEMBL3993928

CC(C)(C)OC(=O)N1CC(O)C(c2ccc(F)cc2)C1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.55
PDE4B Q07343 5/20 0.47
HDAC1 Q13547 1/20 0.46
HDAC2 Q92769 1/20 0.46
TACR1 P25103 5/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NAMPT P43490 1/20 0.42
ENPP2 Q13822 1/20 0.42
LIPE Q05469 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
SCHEMBL16070094 1.00 RORC (0.55) RORCPDE4BHDAC1HDAC2TACR1
SCHEMBL16032347 1.00 RORC (0.55) RORCPDE4BHDAC1HDAC2TACR1
SCHEMBL27688526 0.88 RORC (0.49) RORCPDE4BHDAC1HDAC2TACR1
SCHEMBL4483556 0.88 RORC (0.49) RORCPDE4BHDAC1HDAC2TACR1
SCHEMBL4483563 0.88 RORC (0.49) RORCPDE4BHDAC1HDAC2TACR1
SCHEMBL4944424 0.88 RORC (0.49) RORCPDE4BHDAC1HDAC2TACR1
SCHEMBL4483553 0.88 RORC (0.49) RORCPDE4BHDAC1HDAC2TACR1
SCHEMBL16109014 0.88 ENPP2 (0.51) RORCPDE4BHDAC1HDAC2TACR1
SCHEMBL14934468 0.88 ENPP2 (0.51) RORCPDE4BHDAC1HDAC2TACR1
SCHEMBL14610186 0.88 ENPP2 (0.51) RORCPDE4BHDAC1HDAC2TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970215-B1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY ABBVIE DEUTSCHLAND (DE) 2019-04-17 EP disclosed
US-9656955-B2 Pyrrolidine derivatives, pharmaceutical compositions containing them, and their use in therapy ABBVIE INC. (US) 2017-05-23 US disclosed
US-9650334-B2 Pyrrolidine derivatives, pharmaceutical compositions containing them, and their use in therapy ABBVIE INC. (US) 2017-05-16 US disclosed
EP-2970215-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY AbbVie Deutschland GmbH & Co. KG (DE) 2016-01-20 EP disclosed
WO-2014140310-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY AbbVie Deutschland GmbH & Co. KG (DE) 2014-09-18 WO disclosed
US-20140275087-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY AbbVie Deutschland GmbH & Co. KG (DE) 2014-09-18 US disclosed
US-20140275086-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY AbbVie Deutschland GmbH & Co. KG (DE) 2014-09-18 US disclosed
EP-1670476-A4 PHENYL PYRROLIDINE ETHER TACHYKININ RECEPTOR ANTAGONISTS MERCK & CO INC (US) 2009-05-27 EP disclosed
CN-1859914-A Phenyl pyrrolidine ether tachykinin receptor antagonists MERCK & CO INC (US) 2006-11-08 CN disclosed
EP-1670476-A2 PHENYL PYRROLIDINE ETHER TACHYKININ RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 2006-06-21 EP disclosed
WO-2005032464-A2 PHENYL PYRROLIDINE ETHER TACHYKININ RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2005-04-14 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 (2 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-20140275086-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY SLC6A7, GFPT1, SUGT1 RORC 4254/4885PDE4B 2609/4885HDAC1 1996/4885
US-20140275087-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY SLC6A7, GFPT1, SUGT1 RORC 4254/4885PDE4B 2609/4885HDAC1 1996/4885

“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.