SCHEMBL3962896

SCHEMBL3962896

CCc1ccc(C(=O)NCc2ccc(F)cc2F)cc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.60
GAA P10253 2/20 0.60
MAPK1 P28482 1/20 0.60
NLRP1 Q9C000 1/20 0.60
EPHX2 P34913 6/20 0.55
NR1H4 Q96RI1 2/20 0.55
PPARG P37231 6/20 0.53
ALDH1A1 P00352 2/20 0.51
PLK1 P53350 1/20 0.47

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
SCHEMBL5645307 0.86 EPHX2 (0.58) EPHX2NR1H4PPARG
SCHEMBL6782132 0.84 EPHX2 (0.56) EPHX2NR1H4PPARG
SCHEMBL5643140 0.83 EPHX2 (0.54) EPHX2NR1H4PPARG
SCHEMBL3460904 0.82 EPHX2 (0.57) GAAEPHX2NR1H4PPARGALDH1A1
SCHEMBL8429875 0.82 LMNA (0.70) LMNAGAAEPHX2PPARGALDH1A1
SCHEMBL678099 0.78 CA2 (0.70) EPHX2NR1H4
SCHEMBL5049108 0.77 PPARG (0.59) EPHX2NR1H4PPARG
SCHEMBL23482150 0.76 P2RX7 (0.56)
SCHEMBL3964758 0.76 LMNA (0.68) LMNAGAAMAPK1ALDH1A1
SCHEMBL30259905 0.76 P2RX7 (0.56)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7488844-B2 Therapeutic agents ASTRAZENECA AB (SE) 2009-02-10 US disclosed
US-20070244198-A1 Carboxylic Derivatives LI LANNA 2007-10-18 US disclosed
US-20060258866-A1 Carboxylic derivates ASTRAZENECA AB, A SWEDEN CORPORATION 2006-11-16 US disclosed
EP-1675820-A2 PROPIONIC ACID DERIVATIVES USEFUL IN THE TREATMENT OF LIPID DISORDERS AstraZeneca AB (SE) 2006-07-05 EP disclosed
EP-1676833-A1 Propionic acid derivatives useful in the treatment of lipid disorders AstraZeneca AB (SE) 2006-07-05 EP disclosed
US-20050282822-A1 Therapeutic agents ASTRAZENECA AB (SE) 2005-12-22 US disclosed
US-20050148656-A1 3-(amino-oxo(alkyl, alkyloxy and alkylthio)phenyl) propanoic and propenoic acid derivatives; peroxisome proliferator-activated receptors agonists; dyslipidemias with or without insulin resisitance and associated metabolic disorders (metabolic syndrome) including obesity, hypertension, type 2 diabetes ASTRAZENECA AB (SE) 2005-07-07 US disclosed
WO-2004113270-A2 PROPIONIC ACID DERIVATIVES USEFUL IN THE TREATMENT OF LIPID DISORDERS ASTRAZENECA AB (SE) 2004-12-29 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 (4 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-20070244198-A1 Carboxylic Derivatives GPR119, CPT1A, PC LMNA 1598/4885GAA 299/4885MAPK1 1439/4885
US-20050148656-A1 3-(amino-oxo(alkyl, alkyloxy and alkylthio)phenyl) propanoic and propenoic acid derivatives; peroxisome proliferator-activated receptors agonists; dyslipidemias with or without insulin resisitance and associated metabolic disorders (metabolic syndrome) including obesity, hypertension, type 2 diabetes GPR119, PPARA, PPARG LMNA 2198/4885GAA 2906/4885MAPK1 1774/4885
US-20060258866-A1 Carboxylic derivates GPR119, PC, CPT1A LMNA 1604/4885GAA 297/4885MAPK1 1371/4885
US-20050282822-A1 Therapeutic agents GPR119, LIPC, PNLIP LMNA 855/4885GAA 100/4885MAPK1 1507/4885

“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.