SCHEMBL1744800

SCHEMBL1744800

CC(C)(C)[Si](C)(C)O[C@@H](c1ccc(C(F)(F)F)cc1)[C@@H](C=O)NC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 13/20 0.35
CNR2 P34972 1/20 0.35
EEF2K O00418 1/20 0.33
GPR139 Q6DWJ6 1/20 0.33
CYP26A1 O43174 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL2549581 1.00 PDE2A (0.35) PDE2ACNR2EEF2KGPR139CYP26A1
SCHEMBL1595429 0.81 PDE2A (0.39) PDE2ACNR2EEF2K
SCHEMBL1595431 0.81 PDE2A (0.39) PDE2ACNR2EEF2K
SCHEMBL1743596 0.81 TRPV1 (0.36) PDE2ACNR2CYP3A4
SCHEMBL1596369 0.81 PDE2A (0.37) PDE2ACNR2
SCHEMBL2548062 0.78 CES2 (0.32) EEF2KCYP26A1CYP3A4
SCHEMBL1741901 0.78 PPARA (0.41) PDE2ACNR2CYP3A4
SCHEMBL1741902 0.78 PPARA (0.41) PDE2ACNR2CYP3A4
SCHEMBL5018934 0.77 AKR1C3 (0.39) PDE2ACNR2EEF2KCYP26A1
SCHEMBL1744761 0.77 CNR2 (0.34) PDE2ACNR2EEF2K

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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 PDE2A 2083/4885CNR2 2228/4885EEF2K 48/4885

“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.