SCHEMBL2050194

SCHEMBL2050194

O/N=C1/CCN2CCCCC2C1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.36
L3MBTL3 Q96JM7 5/20 0.35
L3MBTL1 Q9Y468 5/20 0.35
FYN P06241 1/20 0.34
CHRNA7 P36544 1/20 0.33
TSHR P16473 1/20 0.32
CASP1 P29466 1/20 0.32
MBTD1 Q05BQ5 1/20 0.32
TP53BP1 Q12888 1/20 0.32
L3MBTL4 Q8NA19 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
HTR1D P28221 1/20 0.31

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
SCHEMBL6922726 1.00 HTR6 (0.36) HTR6L3MBTL3L3MBTL1FYNCHRNA7
SCHEMBL2050198 1.00 HTR6 (0.36) HTR6L3MBTL3L3MBTL1FYNCHRNA7
SCHEMBL6923393 0.94 CHRNA7 (0.34) L3MBTL3L3MBTL1FYNCHRNA7TSHR
SCHEMBL15320526 0.94 CHRNA7 (0.34) L3MBTL3L3MBTL1FYNCHRNA7TSHR
SCHEMBL152183 0.77 L3MBTL3 (0.33) L3MBTL3L3MBTL1CHRNA7TSHRCASP1
SCHEMBL13497277 0.77 L3MBTL3 (0.33) L3MBTL3L3MBTL1CHRNA7TSHRCASP1
SCHEMBL132222 0.77 SMN1; SMN2 (0.38) L3MBTL3L3MBTL1TSHRCASP1
SCHEMBL130950 0.77 L3MBTL3 (0.33) L3MBTL3L3MBTL1CHRNA7TSHRCASP1
SCHEMBL18995008 0.75 TDP1 (0.33) L3MBTL3L3MBTL1CHRNA7TDP1
SCHEMBL131443 0.74 CHRNA7 (0.50) CHRNA7TSHRCASP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190055204-A1 COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. 2019-02-21 US disclosed
US-10077243-B2 Compounds for treating disorders mediated by metabotropic glutamate receptor 5, and methods of use thereof SUNOVION PHARMACEUTICALS INC. (US) 2018-09-18 US disclosed
US-20140349992-A1 COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2014-11-27 US disclosed
US-8772301-B2 Compounds for treating disorders mediated by metabotropic glutamate receptor 5, and methods of use thereof SUNOVION PHARMACEUTICALS, INC. (US) 2014-07-08 US disclosed
US-20110319380-A1 Compounds for Treating Disorders Mediated by Metabotropic Glutamate Receptor 5, and Methods of Use Thereof SUNOVION PHARMACEUTICALS INC. (US) 2011-12-29 US disclosed
WO-2011075699-A2 COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2011-06-23 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 (4 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-20110319380-A1 Compounds for Treating Disorders Mediated by Metabotropic Glutamate Receptor 5, and Methods of Use Thereof GRM5, GRM2, GRM1 HTR6 130/4885L3MBTL3 3955/4885L3MBTL1 3622/4885
US-10077243-B2 Compounds for treating disorders mediated by metabotropic glutamate receptor 5, and methods of use thereof GRM5, GRIK5, GRM2 HTR6 115/4885L3MBTL3 4354/4885L3MBTL1 4064/4885
US-20190055204-A1 COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF GRM5, GRM2, GRM1 HTR6 130/4885L3MBTL3 3955/4885L3MBTL1 3622/4885
US-20140349992-A1 COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF GRM5, GRM2, GRM1 HTR6 130/4885L3MBTL3 3955/4885L3MBTL1 3622/4885

“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.