SCHEMBL1742709

SCHEMBL1742709

C/C=C/[C@H](c1ccc(C(F)(F)F)cc1)[C@@H](COC(=O)C(C)(C)C)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PRKCA P17252 2/20 0.34
PRKCD Q05655 1/20 0.34
PPARG P37231 2/20 0.33
PPARA Q07869 2/20 0.33
FFAR1 O14842 5/20 0.33
ACP3 P15309 1/20 0.33
SLC6A9 P48067 2/20 0.32
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
UTS2R Q9UKP6 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL1742715 1.00 ALDH1A1 (0.36) ALDH1A1L3MBTL1PRKCAPRKCDPPARG
SCHEMBL1742710 1.00 ALDH1A1 (0.36) ALDH1A1L3MBTL1PRKCAPRKCDPPARG
SCHEMBL1742711 1.00 ALDH1A1 (0.36) ALDH1A1L3MBTL1PRKCAPRKCDPPARG
SCHEMBL2543147 0.84 PPARA (0.42) ALDH1A1L3MBTL1PPARGPPARAUTS2R
SCHEMBL2543137 0.84 PPARA (0.42) ALDH1A1L3MBTL1PPARGPPARAUTS2R
SCHEMBL1743805 0.84 PPARA (0.42) ALDH1A1L3MBTL1PPARGPPARAUTS2R
SCHEMBL1743813 0.84 PPARA (0.42) ALDH1A1L3MBTL1PPARGPPARAUTS2R
SCHEMBL2543143 0.84 PPARA (0.42) ALDH1A1L3MBTL1PPARGPPARAUTS2R
SCHEMBL1743810 0.84 PPARA (0.42) ALDH1A1L3MBTL1PPARGPPARAUTS2R
SCHEMBL1743814 0.84 PPARA (0.42) ALDH1A1L3MBTL1PPARGPPARAUTS2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981884-B1 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS AMGEN INC (US) 2012-06-13 EP disclosed
US-8084479-B2 Thiazole compounds and methods of use AMGEN INC. (US) 2011-12-27 US disclosed
EP-2387570-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE Amgen, Inc (US) 2011-11-23 EP disclosed
US-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2011-10-27 US disclosed
WO-2010083246-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2010-07-22 WO disclosed
US-20090270445-A1 Thiazole compounds and methods of use AMGEN INC. (US) 2009-10-29 US disclosed
US-7514566-B2 Thiazole compounds and methods of use AMGEN, INC. (US) 2009-04-07 US disclosed
EP-1981884-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B (PKB) INHIBITORS Amgen, Inc (US) 2008-10-22 EP disclosed
WO-2007084391-A2 THIAZOLE COMPOUNDS AS PROTEIN KINASE B ( PKB) INHIBITORS AMGEN INC. (US) 2007-07-26 WO disclosed
US-20070173506-A1 Thiazole compounds and methods of use AMGEN INC. (US) 2007-07-26 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 (3 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-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE TFEB, PCK2, JAK2 ALDH1A1 2488/4885L3MBTL1 3916/4885PRKCA 152/4885
US-20090270445-A1 Thiazole compounds and methods of use MTOR, JAK2, TK2 ALDH1A1 2019/4885L3MBTL1 3411/4885PRKCA 95/4885
US-20070173506-A1 Thiazole compounds and methods of use MTOR, JAK2, PCK2 ALDH1A1 2061/4885L3MBTL1 3505/4885PRKCA 206/4885

“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.