SCHEMBL4658204

SCHEMBL4658204

CCOC(=O)C1=C(c2ccccc2)c2ccc(C)cc2C1=O.CCOC(=O)C1=C(c2ccccc2)c2ccc(CBr)cc2C1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 13/20 0.64
ALDH1A1 P00352 4/20 0.49
LMNA P02545 4/20 0.49
MAPT P10636 4/20 0.49
NPSR1 Q6W5P4 4/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
HPGD P15428 3/20 0.49
ALOX12 P18054 3/20 0.49
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
PKM P14618 1/20 0.49
STAT3 P40763 1/20 0.49
KCNH2 Q12809 1/20 0.49
KDM4E B2RXH2 3/20 0.47
HKDC1 Q2TB90 3/20 0.47
HSP90AA1 P07900 2/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 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
SCHEMBL3572958 0.96 PPARG (0.69) PPARGALDH1A1LMNAMAPTNPSR1
SCHEMBL3576647 0.91 PPARG (0.76) PPARGALDH1A1LMNAMAPTNPSR1
SCHEMBL4658819 0.83 PPARG (0.54) PPARGALDH1A1LMNAMAPTNPSR1
SCHEMBL4656828 0.83 PPARG (0.64) PPARGALDH1A1LMNAMAPTNPSR1
SCHEMBL3570952 0.80 PPARG (0.74) PPARGALDH1A1LMNAMAPTNPSR1
SCHEMBL5611249 0.80 FGFR1 (0.62) PPARGALDH1A1LMNAMAPTNPSR1
SCHEMBL7538581 0.80 PPARG (0.72) PPARGALDH1A1LMNAMAPTNPSR1
SCHEMBL144476 0.79 FGFR1 (0.74) PPARGALDH1A1LMNAMAPTNPSR1
SCHEMBL3572575 0.78 PPARG (1.00) PPARGALDH1A1LMNAMAPTNPSR1
SCHEMBL27218306 0.77 FGFR1 (0.74) PPARGALDH1A1LMNAMAPTNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1756036-A4 INDENE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF KOREA RES INST CHEM TECH (KR) 2008-04-16 EP disclosed
EP-1756036-A1 INDENE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Korea Research Institute of Chemical Technology (KR) 2007-02-28 EP disclosed
WO-2005100297-A1 INDENE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2005-10-27 WO disclosed