SCHEMBL2421065

SCHEMBL2421065

CCCCCCCCCCCCCCCCCCOc1ccc(C(CCCCCCCCCCCCCCCC)C(=O)OCC)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
MMP9 P14780 1/20 0.59
MMP8 P22894 1/20 0.59
MMP13 P45452 1/20 0.59
POLB P06746 1/20 0.56
MAPK1 P28482 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
MAPT P10636 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TP53 P04637 1/20 0.52
TSHR P16473 1/20 0.52
SLC2A1 P11166 1/20 0.52
PLA2G4B P0C869 2/20 0.51
CRHBP P24387 1/20 0.51
CRHR2 Q13324 1/20 0.51
NR5A1 Q13285 1/20 0.50
GPR88 Q9GZN0 1/20 0.49

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
SCHEMBL2412575 0.93 LMNA (0.52) LMNAMMP9MMP8MMP13POLB
SCHEMBL9258698 0.91 RARB (0.56) LMNAMMP9MMP8MMP13POLB
SCHEMBL20495545 0.86 LMNA (0.73) LMNAMMP9MMP8MMP13POLB
SCHEMBL28920116 0.85 MEN1 (0.47) LMNAMMP9MMP8MMP13POLB
SCHEMBL28842185 0.85 LMNA (0.57) LMNAMMP9MMP8MMP13L3MBTL1
SCHEMBL22497335 0.85 LMNA (0.57) LMNAMMP9MMP8MMP13L3MBTL1
SCHEMBL27973274 0.85 LMNA (0.57) LMNAMMP9MMP8MMP13L3MBTL1
SCHEMBL5699327 0.84 ESR1 (0.44) LMNAMMP9MMP8MMP13MAPK1
SCHEMBL2384369 0.84 ESR1 (0.44) LMNAMMP9MMP8MMP13MAPK1
SCHEMBL5699336 0.84 ESR1 (0.44) LMNAMMP9MMP8MMP13MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011109525-A1 Aging-Related Circulating Particle-Associated Lipoprotein B Oxidase (apoBNOX) and Inhibitors Thereof NOX TECHNOLOGIES, INC. (US) 2011-09-09 WO disclosed
EP-1494658-B1 NATURAL PHENOLIC PRODUCTS AND DERIVATIVES THEREOF FOR PROTECTION AGAINST NEURODEGENERATIVE DISEASES PULEVA BIOTECH SA (ES) 2006-01-04 EP disclosed
EP-1494658-A1 NATURAL PHENOLIC PRODUCTS AND DERIVATIVES THEREOF FOR PROTECTION AGAINST NEURODEGENERATIVE DISEASES PULEVA BIOTECH, S.A. (ES) 2005-01-12 EP disclosed
US-20030236202-A1 Natural products and derivatives thereof for protection against neurodegenerative diseases PULEVA BIOTECH, S.A. (ES) 2003-12-25 US disclosed
WO-2003082259-A1 NATURAL PHENOLIC PRODUCTS AND DERIVATIVES THEREOF FOR PROTECTION AGAINST NEURODEGENERATIVE DISEASES PULEVA BIOTECH, S.A. (ES) 2003-10-09 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-20030236202-A1 Natural products and derivatives thereof for protection against neurodegenerative diseases SNCA, HTT, PARK7 LMNA 543/4885MMP9 672/4885MMP8 2083/4885

“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.