SCHEMBL2864901

SCHEMBL2864901

Cc1cn(-c2ccc(C)c(Cl)c2)c(=NC(=O)N2CC[C@@H](F)C2)s1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 2/20 0.39
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
GFER P55789 1/20 0.37
GRIN2B Q13224 2/20 0.36
HPGD P15428 2/20 0.34
ACACB O00763 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
LPAR5 Q9H1C0 1/20 0.33
DPP4 P27487 4/20 0.32
DPP7 Q9UHL4 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
LMNA P02545 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL2864897 1.00 PDE4B (0.39) PDE4BMAPTALDH1A1GFERGRIN2B
SCHEMBL4235124 0.94 NOTUM (0.37) PDE4BMAPTALDH1A1GRIN2BHPGD
SCHEMBL4235120 0.94 NOTUM (0.37) PDE4BMAPTALDH1A1GRIN2BHPGD
SCHEMBL4234636 0.92 TP53 (0.34) MAPTALDH1A1GRIN2BHPGDACACB
SCHEMBL4234632 0.92 TP53 (0.34) MAPTALDH1A1GRIN2BHPGDACACB
SCHEMBL4236051 0.89 DPP7 (0.40) GRIN2BHPGDTP53DPP4DPP7
SCHEMBL4236056 0.89 DPP7 (0.40) GRIN2BHPGDTP53DPP4DPP7
SCHEMBL2867031 0.86 DPP4 (0.38) MAPTDPP4DPP7DPP8DPP9
SCHEMBL2867029 0.86 DPP4 (0.38) MAPTDPP4DPP7DPP8DPP9
SCHEMBL2869459 0.85 CYP17A1 (0.35) PDE4BGRIN2BHPGDLPAR5DPP4

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 12 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
US-8383657-B2 Thiazolylidine urea and amide derivatives and methods of use thereof ABBOTT LABORATORIES (US) 2013-02-26 US claimed
US-20090221648-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS ABBOTT LABORATORIES (US) 2009-09-03 US claimed
WO-2009082698-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS ABBOTT LABORATORIES (US) 2009-07-02 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
WO-2009082698-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS ABBOTT LABORATORIES (US) 2009-07-02 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 PDE4B 324/4885MAPT 465/4885ALDH1A1 2649/4885
US-20090221648-A1 COMPOSITIONS FOR TREATMENT OF COGNITIVE DISORDERS CHRNA4, CHRNA5, CHRNA3 PDE4B 235/4885MAPT 290/4885ALDH1A1 2032/4885

“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.