SCHEMBL1799283

SCHEMBL1799283

COC[C@H](CC(C)C)N(CCc1cccc(CCO)c1)C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 4/20 0.38
CYP4A11 Q02928 4/20 0.38
AAK1 Q2M2I8 2/20 0.36
L3MBTL1 Q9Y468 3/20 0.33
ACHE P22303 2/20 0.33
OPRM1 P35372 2/20 0.32
OPRD1 P41143 2/20 0.32
OPRK1 P41145 2/20 0.32
BACE1 P56817 1/20 0.32
CYP2D6 P10635 2/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
RECQL P46063 1/20 0.31
SLC7A5 Q01650 1/20 0.31
AOC3 Q16853 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
SCHEMBL1802422 0.93 CYP4F2 (0.38) CYP4F2CYP4A11AAK1L3MBTL1ACHE
SCHEMBL1798529 0.82 CYP4F2 (0.39) CYP4F2CYP4A11L3MBTL1ACHEBACE1
SCHEMBL1803711 0.81 CYP4F2 (0.40) CYP4F2CYP4A11L3MBTL1BACE1CYP2D6
SCHEMBL1802570 0.81 CYP4F2 (0.40) CYP4F2CYP4A11L3MBTL1BACE1CYP2D6
SCHEMBL1802802 0.80 CYP4F2 (0.39) CYP4F2CYP4A11L3MBTL1BACE1CYP2D6
SCHEMBL1802799 0.80 CYP4F2 (0.39) CYP4F2CYP4A11L3MBTL1BACE1CYP2D6
SCHEMBL1799531 0.78 CYP4F2 (0.43) CYP4F2CYP4A11L3MBTL1ACHEBACE1
SCHEMBL1803069 0.77 CYP4F2 (0.42) CYP4F2CYP4A11SLC7A5
SCHEMBL4761208 0.76 CYP4F2 (0.38) CYP4F2CYP4A11L3MBTL1ACHEOPRM1
SCHEMBL1800151 0.76 CYP4F2 (0.38) CYP4F2CYP4A11L3MBTL1ACHEOPRM1

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-7951954-B2 Bezothiazol derivatives as Beta2 adrenoreceptor agonists ASTRAZENECA AB (SE) 2011-05-31 US disclosed
US-20090062259-A1 Bezothiazol Derivatives as Beta2 Adrenoreceptor Agonists ASTRAZENECA AB (SE) 2009-03-05 US disclosed
EP-1996566-A1 BEZOTHIAZOL DERIVATIVES AS BETA2 ADRENORECEPTOR AGONISTS AstraZeneca AB (SE) 2008-12-03 EP disclosed
WO-2007106016-A1 BEZOTHIAZOL DERIVATIVES AS BETA2 ADRENORECEPTOR AGONISTS ASTRAZENECA AB (SE) 2007-09-20 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-20090062259-A1 Bezothiazol Derivatives as Beta2 Adrenoreceptor Agonists ADRB2, ADRB1, ADRB3 CYP4F2 1476/4885CYP4A11 459/4885AAK1 1062/4885

“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.