SCHEMBL1010100

SCHEMBL1010100

CN(C)c1cccc(OC(CNCc2ccc(OC(C)(C)C(=O)O)cc2)c2nc3ccccc3o2)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 11/20 0.45
PPARG P37231 11/20 0.45
PPARD Q03181 4/20 0.45
ADRB3 P13945 3/20 0.38
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.37
THRB P10828 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL1012094 0.94 PPARA (0.50) PPARAPPARGPPARD
SCHEMBL1012286 0.92 PPARA (0.43) PPARAPPARGPPARDADRB3PTPN2
SCHEMBL1011109 0.91 PPARA (0.50) PPARAPPARGPPARDADRB3PTPN1
SCHEMBL1009671 0.86 PPARA (0.47) PPARAPPARGPPARDADRB3PTPN1
SCHEMBL1010920 0.86 PPARA (0.49) PPARAPPARGPPARD
SCHEMBL1009837 0.86 PPARA (0.52) PPARAPPARGPPARD
SCHEMBL1010691 0.85 PPARA (0.36) PPARAPPARGPPARDPTPN2PTPN1
SCHEMBL1009987 0.83 PPARA (0.48) PPARAPPARGPPARDMAPTPOLB
SCHEMBL1009876 0.82 ADRB3 (0.56) PPARAPPARGPPARDADRB3MAPT
SCHEMBL1010742 0.81 PPARG (0.51) PPARAPPARGPPARDADRB3MAPT

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
EP-1661890-B1 PPAR-ACTIVATING COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING SAME KOWA CO (JP) 2011-01-05 EP disclosed
US-7183295-B2 PPAR-activating compound and pharmaceutical composition comprising the compound KOWA CO., LTD. (JP) 2007-02-27 US disclosed
US-7109226-B2 PPAR-activating compound and pharmaceutical composition comprising the compound KOWA CO., LTD. (JP) 2006-09-19 US disclosed
US-20060189667-A1 PPAR-activating compound and pharmaceutical composition comprising the compound KOWA CO., LTD. (JP) 2006-08-24 US disclosed
EP-1661890-A1 PPAR-ACTIVATING COMPOUND AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Kowa Co., Ltd. (JP) 2006-05-31 EP disclosed
US-20050101636-A1 PPAR-activating compound and pharmaceutical composition comprising the compound KOWA CO., LTD. (JP) 2005-05-12 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-20060189667-A1 PPAR-activating compound and pharmaceutical composition comprising the compound PPARA, PPARG, PPARD PPARA 1/4885PPARG 2/4885PPARD 3/4885
US-20050101636-A1 PPAR-activating compound and pharmaceutical composition comprising the compound PPARG, PPARA, PPARD PPARA 2/4885PPARG 1/4885PPARD 3/4885

“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.