SCHEMBL4385776

SCHEMBL4385776

CCC(=O)c1ccc2c(c1)C[C@@](CC)(C(=O)O)O2

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.48
PPARA Q07869 10/20 0.46
PPARG P37231 6/20 0.46
PPARD Q03181 3/20 0.45
MAPT P10636 3/20 0.37
HPGD P15428 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL3379758 0.89 PPARA (0.47) PPARAPPARGPPARDMAPTPOLB
SCHEMBL4454522 0.82 PPARA (0.51) PPARAPPARGPPARDMAPT
SCHEMBL3380544 0.77 PPARA (0.44) PPARAPPARGPPARDSMN1; SMN2CYP1A2
SCHEMBL7420613 0.77 PPARA (0.44) PPARAPPARGPPARDSMN1; SMN2CYP1A2
SCHEMBL4385772 0.76 PPARA (0.40) PPARAPPARGPPARDMAPTPOLB
SCHEMBL14357334 0.72 ATM (0.50) ATMMAPTHPGDRXFP1SMN1; SMN2
SCHEMBL4456484 0.72 PPARA (0.50) PPARAPPARGPPARD
SCHEMBL23618120 0.71 PPARA (0.41) PPARAPPARGPPARD
SCHEMBL10822265 0.70 RXRA (0.48) MAPTSMN1; SMN2POLBKDM4E
SCHEMBL16196851 0.69 ATM (0.40) ATMPPARAPPARGPPARDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629372-B2 Compounds for the treatment of dyslipidemia and other lipid disorders MERCK & CO., INC. (US) 2009-12-08 US disclosed
US-20080039514-A1 Compounds for the Treatment of Dyslipidemia and Other Lipid Disorders MERCK & CO., INC. (US) 2008-02-14 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-20080039514-A1 Compounds for the Treatment of Dyslipidemia and Other Lipid Disorders LIPA, APOB, LCAT ATM 2123/4885PPARA 111/4885PPARG 152/4885

“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.