SCHEMBL918296

SCHEMBL918296

CC(C)(C)OC[C@H](NC(=O)[C@H](N)c1ccccc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRN P28799 1/20 0.49
SORT1 Q99523 1/20 0.49
PYGL P06737 1/20 0.45
CYP2C9 P11712 1/20 0.45
MME P08473 8/20 0.43
PPARA Q07869 2/20 0.42
PPARG P37231 1/20 0.40
KEAP1 Q14145 1/20 0.40
CTSS P25774 2/20 0.39
CTSK P43235 2/20 0.39
BACE1 P56817 1/20 0.39
ACE2 Q9BYF1 2/20 0.39
ACE P12821 1/20 0.38
CPA1 P15085 1/20 0.38
CTSL P07711 1/20 0.38

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
SCHEMBL918298 1.00 GRN (0.49) GRNSORT1PYGLCYP2C9MME
SCHEMBL919340 0.88 CTSS (0.42) GRNSORT1CTSSCTSKCTSL
SCHEMBL30999375 0.82 CTSC (0.50) GRNSORT1MMEPPARA
SCHEMBL8344033 0.77 MME (0.63) MME
SCHEMBL29359001 0.77 MME (0.63) MME
SCHEMBL18127055 0.77 GRN (0.68) GRNSORT1PYGLCYP2C9PPARA
SCHEMBL30182824 0.77 PPARA (0.47) GRNSORT1PYGLCYP2C9MME
SCHEMBL29684253 0.77 OPRD1 (0.49)
SCHEMBL920209 0.76 CTSS (0.58) MMEPPARACTSSCTSKBACE1
SCHEMBL920208 0.76 CTSS (0.58) MMEPPARACTSSCTSKBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7871998-B2 Diphenylazetidinone derivatives possessing cholesterol absorption inhibitory activity ASTRAZENECA AB (SE) 2011-01-18 US disclosed
EP-1699759-B1 DIPHENYLAZETIDINONE DERIVATES POSSESSING CHOLESTEROL ABSORPTION INHIBITORY ACTIVITY ASTRAZENECA AB (SE) 2010-10-20 EP disclosed
US-20100099657-A2 Diphenylazetidinone Derivatives Possessing Cholesterol Absorption Inhibitory Activity ASTRAZENECA AB (SE) 2010-04-22 US disclosed
US-7470678-B2 Diphenylazetidinone derivatives for treating disorders of the lipid metabolism ASTRAZENECA AB (SE) 2008-12-30 US disclosed
US-20080064676-A1 Diphenylazetidinone Derivatives Possessing Cholesterol Absorption Inhibitory Activity ASTRAZENECA AB (SE) 2008-03-13 US disclosed
US-20050239766-A1 Diphenylazetidinone derivatives for treating disorders of the lipid metabolism ASTRAZENECA AB (SE) 2005-10-27 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-20050239766-A1 Diphenylazetidinone derivatives for treating disorders of the lipid metabolism CYP46A1, CYP27A1, CYP7A1 GRN 3599/4885SORT1 1021/4885PYGL 113/4885
US-20100099657-A2 Diphenylazetidinone Derivatives Possessing Cholesterol Absorption Inhibitory Activity CYP46A1, CYP51A1, DHCR7 GRN 3964/4885SORT1 743/4885PYGL 166/4885
US-20080064676-A1 Diphenylazetidinone Derivatives Possessing Cholesterol Absorption Inhibitory Activity CYP46A1, CYP51A1, DHCR7 GRN 3964/4885SORT1 743/4885PYGL 166/4885

“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.