SCHEMBL1712741

SCHEMBL1712741

CC(=O)N(C)C1CCN(C=O)C1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PYGL P06737 2/20 0.40
MCHR1 Q99705 1/20 0.39
VNN1 O95497 4/20 0.36
MAP4K4 O95819 1/20 0.36
LTA4H P09960 1/20 0.36
PDK2 Q15119 1/20 0.36
DPP4 P27487 3/20 0.35
DPP8 Q6V1X1 1/20 0.35
LMNA P02545 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
USP30 Q70CQ3 2/20 0.33

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
SCHEMBL1307160 1.00 PYGL (0.40) PYGLMCHR1VNN1MAP4K4LTA4H
SCHEMBL21539706 0.89 LMNA (0.38) PYGLMCHR1VNN1MAP4K4LTA4H
SCHEMBL21790197 0.83 CCR5 (0.41) PYGLVNN1DPP4DPP8USP30
SCHEMBL404146 0.79 L3MBTL3 (0.35) PYGLMCHR1
SCHEMBL1309093 0.79 L3MBTL3 (0.35) PYGLMCHR1
SCHEMBL13955505 0.79 L3MBTL3 (0.35) PYGLMCHR1
SCHEMBL21201850 0.76 ADH1C (0.47) PYGL
SCHEMBL799469 0.76 MCHR1 (0.43) MCHR1VNN1MAP4K4LMNAHRH3
SCHEMBL8272497 0.76 MCHR1 (0.43) MCHR1VNN1MAP4K4LMNAHRH3
SCHEMBL21201804 0.76 PYGL (0.33) PYGL

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
US-20200308109-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC (JP) 2020-10-01 US disclosed
US-20190177271-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC (JP) 2019-06-13 US disclosed
US-20150329491-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC (JP) 2015-11-19 US disclosed
EP-2345629-B1 FLUORENE COMPOUND AND USE THEREOF FOR MEDICAL PURPOSES JAPAN TOBACCO INC (JP) 2015-06-03 EP disclosed
US-8871934-B2 Fluorene compound and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2014-10-28 US disclosed
US-20130274240-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF JAPAN TOBACCO INC (US) 2013-10-17 US disclosed
US-8343994-B2 Fluorene compound and pharmaceutical use thereof JAPAN TOBACCO INC. (JP) 2013-01-01 US disclosed
EP-2345629-A1 FLUORENE COMPOUND AND USE THEREOF FOR MEDICAL PURPOSES Japan Tobacco, Inc. (JP) 2011-07-20 EP disclosed
US-20100240634-A1 Fluorene Compound and Pharmaceutical Use Thereof JAPAN TOBACCO INC. (JP) 2010-09-23 US disclosed
US-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 US disclosed
US-20090275555-A1 Substituted indole ligands for the ORL-1 receptor BRANE DISCOVERY S.R.L. (IT) 2009-11-05 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 (6 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-20150329491-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC PYGL 449/4885MCHR1 4570/4885VNN1 4816/4885
US-20100240634-A1 Fluorene Compound and Pharmaceutical Use Thereof FH, PCK2, PC PYGL 449/4885MCHR1 4570/4885VNN1 4816/4885
US-20090275555-A1 Substituted indole ligands for the ORL-1 receptor OGFRL1, OPRL1, ORMDL3 PYGL 1968/4885MCHR1 22/4885VNN1 3593/4885
US-20130274240-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC PYGL 449/4885MCHR1 4570/4885VNN1 4816/4885
US-20190177271-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC PYGL 449/4885MCHR1 4570/4885VNN1 4816/4885
US-20200308109-A1 FLUORENE COMPOUND AND PHARMACEUTICAL USE THEREOF FH, PCK2, PC PYGL 449/4885MCHR1 4570/4885VNN1 4816/4885

“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.