SCHEMBL2868670

SCHEMBL2868670

CCN(CCN(C)C)C(=O)N=c1sc(C)cn1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.34
PTGDR2 Q9Y5Y4 2/20 0.33
UTS2R Q9UKP6 6/20 0.32
TRPV1 Q8NER1 1/20 0.32
TRPM8 Q7Z2W7 1/20 0.32
CNR1 P21554 2/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
SCN9A Q15858 1/20 0.31
MCHR1 Q99705 2/20 0.31
MAPT P10636 1/20 0.31
KCNH2 Q12809 1/20 0.31
GRM5 P41594 1/20 0.31
GRM1 Q13255 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
SCHEMBL2868669 1.00 CNR2 (0.34) CNR2PTGDR2UTS2RTRPV1TRPM8
SCHEMBL2837496 0.93 CNR2 (0.34) CNR2PTGDR2TRPV1TRPM8CNR1
SCHEMBL2837497 0.93 CNR2 (0.34) CNR2PTGDR2TRPV1TRPM8CNR1
SCHEMBL2872819 0.92 TRPM8 (0.35) CNR2PTGDR2TRPV1TRPM8CNR1
SCHEMBL2872822 0.92 TRPM8 (0.35) CNR2PTGDR2TRPV1TRPM8CNR1
SCHEMBL2873987 0.91 UTS2R (0.33) CNR2UTS2RCNR1HSP90AA1HSP90AB1
SCHEMBL2873991 0.91 UTS2R (0.33) CNR2UTS2RCNR1HSP90AA1HSP90AB1
SCHEMBL4231666 0.91 CNR2 (0.37) CNR2TRPV1TRPM8CNR1
SCHEMBL4231664 0.91 CNR2 (0.37) CNR2TRPV1TRPM8CNR1
SCHEMBL2837583 0.89 CNR2 (0.40) CNR2PTGDR2TRPV1TRPM8CNR1

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-2245020-B1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBVIE INC (US) 2014-01-15 EP claimed
EP-2245020-A2 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF Abbott Laboratories (US) 2010-11-03 EP claimed
US-20090221648-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS ABBOTT LABORATORIES (US) 2009-09-03 US claimed
WO-2009086163-A2 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-07-09 WO claimed
US-20090163470-A1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-06-25 US claimed
EP-2245020-B1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBVIE INC (US) 2014-01-15 EP disclosed
US-8383657-B2 Thiazolylidine urea and amide derivatives and methods of use thereof ABBOTT LABORATORIES (US) 2013-02-26 US disclosed
EP-2245020-A2 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF Abbott Laboratories (US) 2010-11-03 EP disclosed
US-20090221648-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS ABBOTT LABORATORIES (US) 2009-09-03 US disclosed
WO-2009086163-A2 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-07-09 WO disclosed
US-20090163470-A1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF ABBOTT LABORATORIES (US) 2009-06-25 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 (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-20090163470-A1 THIAZOLYLIDINE UREA AND AMIDE DERIVATIVES AND METHODS OF USE THEREOF NMUR1, NMUR2, PAM CNR2 156/4885PTGDR2 615/4885UTS2R 5/4885
US-20090221648-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS CHRNA4, CHRNA5, CHRNA3 CNR2 91/4885PTGDR2 570/4885UTS2R 586/4885

“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.