SCHEMBL7906004

SCHEMBL7906004

COC(=O)/C=C/C1(c2ccc(Cl)c(Cl)c2)CCC2(CC1)OCCO2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.49
SLC6A3 Q01959 3/20 0.49
RARB P10826 1/20 0.37
RARG P13631 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
OPRM1 P35372 1/20 0.36
SLC6A2 P23975 6/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 3/20 0.34
MEN1 O00255 1/20 0.34
PLA2G1B P04054 1/20 0.34
KMT2A Q03164 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL10052504 0.77 SLC6A4 (0.53) SLC6A4SLC6A3SLC6A2SMN1; SMN2MAPT
SCHEMBL13543971 0.75 CCR5 (0.41) SMN1; SMN2MAPTMEN1KMT2ATSHR
SCHEMBL14944336 0.70 HDAC4 (0.43) SLC6A4SLC6A3RXRARXRBRXRG
SCHEMBL10052514 0.68 SLC6A3 (0.47) SLC6A4SLC6A3SLC6A2NPC1RAB9A
SCHEMBL13253927 0.66 SLC6A4 (1.00) SLC6A4SLC6A3SLC6A2
SCHEMBL20876280 0.64 SLC6A4 (0.45) SLC6A4SLC6A3OPRM1SLC6A2
SCHEMBL10052501 0.64 OPRM1 (0.57) SLC6A4SLC6A3OPRM1SLC6A2
SCHEMBL20500670 0.64 SLC6A4 (0.44) SLC6A4SLC6A3SMN1; SMN2MAPTMEN1
SCHEMBL5153993 0.64 SLC6A4 (1.00) SLC6A4SLC6A3SLC6A2
SCHEMBL14893938 0.63 OPRM1 (0.57) SLC6A4SLC6A3OPRM1SLC6A2SMN1; 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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9505716-B2 Pyrrolidine triple reuptake inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2016-11-29 US disclosed
US-9505716-B2 Pyrrolidine triple reuptake inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2016-11-29 US disclosed
US-20160115123-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SUNOVION PHARMACEUTICALS INC. 2016-04-28 US disclosed
US-20160115123-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SUNOVION PHARMACEUTICALS INC. 2016-04-28 US disclosed
EP-2974724-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS Sunovion Pharmaceuticals Inc. (US) 2016-01-20 EP disclosed
US-9056830-B2 Pyrrolidine triple reuptake inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2015-06-16 US disclosed
US-9056830-B2 Pyrrolidine triple reuptake inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2015-06-16 US disclosed
US-8754117-B2 Pyrrolidine triple reuptake inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2014-06-17 US disclosed
US-8754117-B2 Pyrrolidine triple reuptake inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2014-06-17 US disclosed
US-20140073682-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SUNOVION PHARMACEUTICALS INC. (US) 2014-03-13 US disclosed
US-20140073682-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SUNOVION PHARMACEUTICALS INC. (US) 2014-03-13 US disclosed
US-20130137744-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SUNOVION PHARMACEUTICAL INC. (US) 2013-05-30 US disclosed
US-20130137744-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SUNOVION PHARMACEUTICAL INC. (US) 2013-05-30 US disclosed
US-8389559-B2 Pyrrolidine triple reuptake inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2013-03-05 US disclosed
US-8389559-B2 Pyrrolidine triple reuptake inhibitors SUNOVION PHARMACEUTICALS INC. (US) 2013-03-05 US disclosed
US-20120022125-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SUNOVION PHARMACEUTICALS INC. 2012-01-26 US disclosed
US-20120022125-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SUNOVION PHARMACEUTICALS INC. 2012-01-26 US disclosed
WO-2010091268-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SEPRACOR INC. (US) 2010-08-12 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-20120022125-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SLC18A2, SLC6A2, SLC6A3 SLC6A4 4/4885SLC6A3 3/4885RARB 4043/4885
US-20140073682-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SLC18A2, SLC6A2, SLC6A3 SLC6A4 4/4885SLC6A3 3/4885RARB 4043/4885
US-20160115123-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SLC18A2, SLC6A2, SLC6A3 SLC6A4 4/4885SLC6A3 3/4885RARB 4043/4885
US-20130137744-A1 PYRROLIDINE TRIPLE REUPTAKE INHIBITORS SLC18A2, SLC6A2, SLC6A3 SLC6A4 4/4885SLC6A3 3/4885RARB 4043/4885

“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.