SCHEMBL5083020

SCHEMBL5083020

O=C(OCc1ccc2ccccc2c1-c1c(COC(=O)c2ccccc2)ccc2ccccc12)c1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.63
TDP1 Q9NUW8 3/20 0.53
KMT2A Q03164 3/20 0.53
SLC6A2 P23975 1/20 0.53
SLC6A3 Q01959 1/20 0.53
MAPK1 P28482 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
LMNA P02545 3/20 0.45
HIF1A Q16665 1/20 0.45
WDR5 P61964 1/20 0.45
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
RAB9A P51151 2/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.41
NPC1 O15118 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL17537989 0.83 TDP1 (0.63) PPARGTDP1KMT2ASLC6A2SLC6A3
SCHEMBL23228451 0.78 PPARG (0.67) PPARGTDP1KMT2ASLC6A2SLC6A3
SCHEMBL19248489 0.78 KMT2A (0.56) PPARGTDP1KMT2ASLC6A2SLC6A3
SCHEMBL5085480 0.77 PPARG (0.71) PPARGTDP1KMT2ASLC6A2SLC6A3
SCHEMBL11318215 0.77 PPARG (0.61) PPARGTDP1KMT2ASLC6A2SLC6A3
Benzoic Acid SCHEMBL5083022 0.76 WDR5 (0.53) TDP1KMT2AWDR5MEN1TSHR
SCHEMBL30275451 0.75 PPARG (0.59) PPARGTDP1KMT2ASLC6A2LMNA
SCHEMBL6243415 0.75 PPARG (0.63) PPARGTDP1KMT2ASLC6A2SLC6A3
SCHEMBL29853739 0.74 TDP1 (0.66) PPARGTDP1KMT2ASLC6A2SLC6A3
SCHEMBL4645175 0.74 TDP1 (0.66) PPARGTDP1KMT2ASLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1666505-B1 CATALYST COMPONENTS CATALYSTS FOR OLEFINIC POLYMERIZATION AND THE USE THEREOF CHINA PETROLEUM & CHEMICAL (CN) 2016-03-23 EP disclosed
US-7332455-B2 Catalyst component and catalyst for olefin polymerization as well as use thereof CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2008-02-19 US disclosed
EP-1666505-A1 CATALYST COMPONENTS CATALYSTS FOR OLEFINIC POLYMERIZATION AND THE USE THEREOF China Petroleum & Chemical Corporation (CN) 2006-06-07 EP disclosed
US-20050119427-A1 Catalyst component and catalyst for olefin polymerization as well as use thereof BEIJING RESEARCH INSTITUTE OF CHEMICAL INDUSTRY, CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2005-06-02 US disclosed