SCHEMBL6779445

SCHEMBL6779445

Cc1ccc(CN(CC(=O)Nc2cccc3c2CCCC3)Cc2ccc(OC(C)(C)C(=O)O)cc2)o1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 14/20 0.60
PPARG P37231 2/20 0.56
PPARD Q03181 1/20 0.56
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
SCHEMBL6779046 0.91 PPARA (0.50) PPARAPPARGPPARDLMNAL3MBTL1
SCHEMBL7143923 0.86 PPARA (0.48) PPARAPPARGPPARDLMNAL3MBTL1
SCHEMBL7143921 0.85 LMNA (0.47) PPARAPPARGPPARDLMNAL3MBTL1
SCHEMBL6779980 0.80 PPARA (0.63) PPARAPPARGPPARDLMNAKDM4E
SCHEMBL6781011 0.77 PPARA (0.56) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL6778821 0.76 PPARA (0.54) PPARAPPARGPPARDMEN1KMT2A
Hydrochloric Acid SCHEMBL6783867 0.75 PPARA (0.53) PPARAPPARGPPARDMEN1KMT2A
SCHEMBL6779865 0.73 PPARA (0.51) PPARAPPARGPPARDKDM4EALDH1A1
SCHEMBL6785404 0.72 PPARA (1.00) PPARAPPARGPPARD
SCHEMBL6781210 0.72 PPARA (1.00) PPARAPPARGPPARD

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-20040176445-A1 Propionic acid derivatives BAYER PHARMACEUTICALS CORPORATION 2004-09-09 US disclosed
US-6750236-B2 CARDIOVASCULAR DISORDERS BAYER AKTIENGESELLSCHAFT (DE) 2004-06-15 US disclosed
US-20030187041-A1 Propionic acid derivatives URBAHNS KLAUS (DE) 2003-10-02 US disclosed
US-6548538-B2 Potent peroxisome proliferator activated receptor (PPAR)-alpha-activating compounds; propionic acid 2-subsituted with an N-(phenylaminocarbonylalkyl), N-(2-furanylmethyl)aminoalkylphenyl group BAYER AKTIENGESELLSCHAFT (DE) 2003-04-15 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-20030187041-A1 Propionic acid derivatives PPARA, PPARD, PPARG PPARA 1/4885PPARG 3/4885PPARD 2/4885
US-20040176445-A1 Propionic acid derivatives PPARD, PPARA, PPARG PPARA 2/4885PPARG 3/4885PPARD 1/4885

“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.