SCHEMBL7855545

SCHEMBL7855545

CCOC(=O)C(Cc1ccc(OCC/C=C2/c3cnccc3-c3cccnc32)cc1)OC

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.45
PPARA Q07869 14/20 0.42
PPARD Q03181 8/20 0.39
FAAH O00519 1/20 0.35
ITGB3 P05106 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGAV P06756 1/20 0.33
ITGB6 P18564 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL7855547 1.00 PPARG (0.45) PPARGPPARAPPARDFAAHITGB3
SCHEMBL7851898 0.93 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL7851899 0.93 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL7843860 0.91 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL7843858 0.91 PPARG (0.49) PPARGPPARAPPARD
SCHEMBL7855863 0.91 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL7852902 0.91 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL7851931 0.91 PPARG (0.50) PPARGPPARAPPARDITGB3ITGB1
SCHEMBL7851926 0.91 PPARG (0.50) PPARGPPARAPPARDITGB3ITGB1
SCHEMBL7843313 0.88 PPARG (0.48) PPARGPPARAPPARD

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-6300339-B1 USEFUL FOR THRERAPY AND/OR PROPHYLAXIS OF INSULIN RESISTANCE (TYPE 2 DIABETES), IMPAIRED GLUCOSE TOLERANCE, DYSLIPIDEMIA, HYPERTENSION, OBESITY, INSULIN RESISTANCE, HYPERGLYCEMIA, ATHEROSCLEROSIS, HYPERLIPIDEMIA, CORONARY ARTERY DISEASE NOVO NORDISK A/S (DK) 2001-10-09 US claimed
EP-1123292-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2001-08-16 EP claimed
WO-2000023445-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-04-27 WO claimed
US-6300339-B1 USEFUL FOR THRERAPY AND/OR PROPHYLAXIS OF INSULIN RESISTANCE (TYPE 2 DIABETES), IMPAIRED GLUCOSE TOLERANCE, DYSLIPIDEMIA, HYPERTENSION, OBESITY, INSULIN RESISTANCE, HYPERGLYCEMIA, ATHEROSCLEROSIS, HYPERLIPIDEMIA, CORONARY ARTERY DISEASE NOVO NORDISK A/S (DK) 2001-10-09 US disclosed
EP-1123292-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2001-08-16 EP disclosed
WO-2000023445-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-04-27 WO disclosed