SCHEMBL7855068

SCHEMBL7855068

CCCOC(Cc1ccc(OCCn2c3ccccc3c3ccccc32)cc1)C(=O)O

nearest known ligand 0.86

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.86
PPARA Q07869 17/20 0.86
PPARD Q03181 5/20 0.86
PGR P06401 1/20 0.49
ADORA3 P0DMS8 1/20 0.49
CHRM1 P11229 1/20 0.49
TBXA2R P21731 1/20 0.49
PTGS1 P23219 1/20 0.49
SLC6A2 P23975 1/20 0.49
PDE4A P27815 1/20 0.49
ADRA1A P35348 1/20 0.49
DRD3 P35462 1/20 0.49

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
SCHEMBL7530870 1.00 PPARG (0.86) PPARGPPARAPPARDPGRADORA3
SCHEMBL7533813 0.95 PPARG (0.77) PPARGPPARAPPARDPGRADORA3
SCHEMBL30583368 0.92 PPARA (1.00) PPARGPPARAPPARDPGRADORA3
SCHEMBL4316922 0.92 PPARA (1.00) PPARGPPARAPPARDPGRADORA3
SCHEMBL4316930 0.92 PPARA (1.00) PPARGPPARAPPARDPGRADORA3
SCHEMBL7527487 0.92 PPARG (0.88) PPARGPPARAPPARDPGRADORA3
SCHEMBL7536112 0.92 PPARG (0.72) PPARGPPARAPPARDPGRADORA3
SCHEMBL7529590 0.90 PPARG (0.70) PPARGPPARAPPARD
SCHEMBL7852634 0.88 PPARG (0.80) PPARGPPARAPPARD
SCHEMBL7532140 0.88 PPARG (0.80) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1123279-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2001-08-16 EP claimed
WO-2000023425-A1 NEW COMPOUNDS, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-04-27 WO claimed