SCHEMBL1048271

SCHEMBL1048271

CC(C(=O)O)c1cccc(Oc2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 5/20 0.75
MEN1 O00255 1/20 0.56
CYP2D6 P10635 1/20 0.56
KMT2A Q03164 1/20 0.56
APP P05067 1/20 0.48
PTGS2 P35354 5/20 0.48
MAPT P10636 2/20 0.48
CXCR1 P25024 2/20 0.48
CXCR2 P25025 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
SLC22A6 Q4U2R8 2/20 0.48
RECQL P46063 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
MAPK1 P28482 1/20 0.48
PMP22 Q01453 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL11833855 0.88 PTGS1 (0.80) PTGS1MEN1CYP2D6KMT2APTGS2
Fenoprofen SCHEMBL3797 0.86 PTGS1 (1.00) PTGS1MEN1CYP2D6KMT2APTGS2
(S)-Fenoprofen SCHEMBL4492279 0.86 PTGS1 (1.00) PTGS1MEN1CYP2D6KMT2APTGS2
R-Fenoprofen SCHEMBL4082 0.86 PTGS1 (1.00) PTGS1MEN1CYP2D6KMT2APTGS2
R-Fenoprofen SCHEMBL30910976 0.86 PTGS1 (1.00) PTGS1MEN1CYP2D6KMT2APTGS2
Fenoprofen SCHEMBL11336376 0.86 PTGS1 (1.00) PTGS1MEN1CYP2D6KMT2APTGS2
Fenoprofen SCHEMBL8754928 0.86 PTGS1 (1.00) PTGS1MEN1CYP2D6KMT2APTGS2
Fenoprofen SCHEMBL29481372 0.86 PTGS1 (1.00) PTGS1MEN1CYP2D6KMT2APTGS2
Fenoprofen SCHEMBL11125651 0.84 PTGS1 (0.97) PTGS1MEN1CYP2D6KMT2APTGS2
Fenoprofen SCHEMBL4081 0.84 PTGS1 (0.97) PTGS1MEN1CYP2D6KMT2APTGS2

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-20110021471-A1 REDUCING Abeta42 LEVELS AND Abeta AGGREGATION MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH 2011-01-27 US disclosed
WO-2009059239-A2 REDUCING Aβ42 LEVELS AND Aβ AGGREGATION MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2009-05-07 WO disclosed
US-20080021085-A1 METHOD OF REDUCING ABETA42 AND TREATING DISEASES MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2008-01-24 US disclosed
US-20080021085-A1 METHOD OF REDUCING ABETA42 AND TREATING DISEASES MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2008-01-24 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 (2 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-20110021471-A1 REDUCING Abeta42 LEVELS AND Abeta AGGREGATION APP, BACE1, GAP43 PTGS1 2370/4885MEN1 2435/4885CYP2D6 4839/4885
US-20080021085-A1 METHOD OF REDUCING ABETA42 AND TREATING DISEASES BACE1, BACE2, APP PTGS1 1377/4885MEN1 1816/4885CYP2D6 2583/4885

“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.