SCHEMBL5365883

SCHEMBL5365883

CC[C@](C)(Oc1ccc(OCc2ccccc2)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.61
MAOB P27338 1/20 0.59
NR4A1 P22736 1/20 0.58
NR4A2 P43354 1/20 0.58
NR4A3 Q92570 1/20 0.58
MAPT P10636 2/20 0.58
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
PPARA Q07869 4/20 0.56
PPARD Q03181 1/20 0.56
PARP10 Q53GL7 1/20 0.55
SRD5A2 P31213 1/20 0.54
ADORA3 P0DMS8 1/20 0.52
HDAC3 O15379 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC2 Q92769 1/20 0.52
NCOR2 Q9Y618 1/20 0.52
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51

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
SCHEMBL4865374 1.00 PPARG (0.61) PPARGMAOBNR4A1NR4A2NR4A3
SCHEMBL5365583 1.00 PPARG (0.61) PPARGMAOBNR4A1NR4A2NR4A3
SCHEMBL5099266 0.88 PPARG (0.72) PPARGMAOBNR4A1NR4A2NR4A3
SCHEMBL3823938 0.87 NR4A2 (0.57) PPARGMAOBNR4A1NR4A2NR4A3
SCHEMBL14184548 0.87 NR4A2 (0.57) PPARGMAOBNR4A1NR4A2NR4A3
SCHEMBL14184546 0.87 NR4A2 (0.57) PPARGMAOBNR4A1NR4A2NR4A3
SCHEMBL14487046 0.87 KDM4E (0.57) PPARGMAOBNR4A1NR4A2NR4A3
SCHEMBL14487049 0.87 KDM4E (0.57) PPARGMAOBNR4A1NR4A2NR4A3
SCHEMBL4863258 0.87 KDM4E (0.57) PPARGMAOBNR4A1NR4A2NR4A3
SCHEMBL5660644 0.86 OPRK1 (0.60) PPARGMAOBNR4A1NR4A2NR4A3

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-7230129-B2 Process for the preparation of optically pure isomers of 2-(4-hydroxy phenoxy)-2-methyl-butyric acid methyl ester DR. REDDY'S LABORATORIES LIMITED (IN) 2007-06-12 US claimed
US-20060194980-A1 Process for the preparation of optically pure isomers of 2-(4-hydroxy phenoxy)-2-methyl-butyric acid methyl ester DR. REDDY'S LABORATORIES LIMITED (IN) 2006-08-31 US claimed
US-7230129-B2 Process for the preparation of optically pure isomers of 2-(4-hydroxy phenoxy)-2-methyl-butyric acid methyl ester DR. REDDY'S LABORATORIES LIMITED (IN) 2007-06-12 US disclosed
US-7230129-B2 Process for the preparation of optically pure isomers of 2-(4-hydroxy phenoxy)-2-methyl-butyric acid methyl ester DR. REDDY'S LABORATORIES LIMITED (IN) 2007-06-12 US disclosed
US-7230129-B2 Process for the preparation of optically pure isomers of 2-(4-hydroxy phenoxy)-2-methyl-butyric acid methyl ester DR. REDDY'S LABORATORIES LIMITED (IN) 2007-06-12 US disclosed
US-20060194980-A1 Process for the preparation of optically pure isomers of 2-(4-hydroxy phenoxy)-2-methyl-butyric acid methyl ester DR. REDDY'S LABORATORIES LIMITED (IN) 2006-08-31 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 (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-20060194980-A1 Process for the preparation of optically pure isomers of 2-(4-hydroxy phenoxy)-2-methyl-butyric acid methyl ester HBB, GABBR2, GABRB2 PPARG 2787/4885MAOB 379/4885NR4A1 1446/4885

“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.