SCHEMBL4746709

SCHEMBL4746709

COC(=O)C1CCN1Cc1ccc(OCc2nc(-c3ccc(C)cc3)oc2C)cc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 7/20 0.55
PPARA Q07869 7/20 0.55
POLB P06746 2/20 0.52
MAPT P10636 5/20 0.51
TP53 P04637 4/20 0.51
FFAR1 O14842 1/20 0.49
KMT2A Q03164 1/20 0.46

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
SCHEMBL4746707 1.00 PPARG (0.55) PPARGPPARAPOLBMAPTTP53
SCHEMBL4748103 0.95 PPARG (0.53) PPARGPPARAPOLBMAPTTP53
SCHEMBL4748101 0.95 PPARG (0.53) PPARGPPARAPOLBMAPTTP53
SCHEMBL4747388 0.93 FFAR1 (0.59) PPARGPPARAMAPTFFAR1
SCHEMBL4747390 0.93 FFAR1 (0.59) PPARGPPARAMAPTFFAR1
SCHEMBL4746614 0.92 PPARG (0.56) PPARGPPARA
SCHEMBL4746609 0.92 PPARG (0.56) PPARGPPARA
SCHEMBL4747043 0.91 PPARG (0.50) PPARGPPARAPOLBMAPTTP53
SCHEMBL4747044 0.91 PPARG (0.50) PPARGPPARAPOLBMAPTTP53
SCHEMBL4744657 0.90 PPARG (0.53) PPARGPPARAMAPTTP53KMT2A

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
WO-2008117982-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR INHIBITING LIPID ACCUMULATION CONTAINING SAME CRYSTAL GENOMICS, INC. (KR) 2008-10-02 WO claimed
WO-2008117982-A1 HETEROCYCLIC CARBOXYLIC ACID DERIVATIVES AND PHARMACEUTICAL COMPOSITION FOR INHIBITING LIPID ACCUMULATION CONTAINING SAME CRYSTAL GENOMICS, INC. (KR) 2008-10-02 WO disclosed