SCHEMBL2522663

SCHEMBL2522663

CSCc1ccc(B2OC(C)(C)C(C)(C)O2)c(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LPL P06858 6/20 0.37
LIPG Q9Y5X9 6/20 0.37
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
UCHL1 P09936 1/20 0.33
F11 P03951 1/20 0.33
NPSR1 Q6W5P4 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
ESR2 Q92731 1/20 0.31
JAK2 O60674 1/20 0.31
BTK Q06187 1/20 0.31
IDO1 P14902 1/20 0.30

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
SCHEMBL29531067 0.81 LPL (0.39) LPLLIPGUCHL1F11CYP3A4
SCHEMBL2699203 0.81 LIPG (0.39) LPLLIPGUCHL1F11CYP3A4
SCHEMBL22982573 0.81 LPL (0.39) LPLLIPGUCHL1F11CYP3A4
SCHEMBL19336172 0.80 LIPG (0.51) LPLLIPGUCHL1F11ESR2
SCHEMBL17261770 0.79 LPL (0.37) LPLLIPGUCHL1F11LMNA
SCHEMBL12278861 0.79 NPSR1 (0.33) KDM4EALDH1A1GAANPSR1LMNA
SCHEMBL2522891 0.77 LPL (0.36) LPLLIPGUCHL1F11CYP3A4
SCHEMBL31379113 0.76 JAK2 (0.32) LPLLIPGALDH1A1JAK2BTK
SCHEMBL22748772 0.75 LPL (0.61) LPLLIPGKDM4EALDH1A1LMNA
SCHEMBL22748354 0.75 LPL (0.61) LPLLIPGKDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110251173-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2011-10-13 US disclosed
US-20110251173-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2011-10-13 US disclosed
US-20110251173-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2011-10-13 US disclosed
WO-2011121350-A1 4 -AMINO -7,8- DIHYDROPYRIMIDO [5, 4 - F] [1, 4] OXAZEPIN- 5 ( 6H) - ONE BASED DGAT1 INHIBITORS ASTRAZENECA AB (SE) 2011-10-06 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-20110251173-A1 CHEMICAL COMPOUNDS DGAT1, DGAT2, SLC5A1 LPL 97/4885LIPG 620/4885KDM4E 4123/4885

“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.