SCHEMBL4578281

SCHEMBL4578281

Cc1cccc(C(OC(=O)c2ccccc2)OC(=O)c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 1/20 0.47
TSHR P16473 2/20 0.47
TP53 P04637 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.45
CYP3A4 P08684 1/20 0.45
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
POLB P06746 2/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
PARP1 P09874 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
GPR139 Q6DWJ6 1/20 0.43

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
SCHEMBL828657 0.82 TSHR (0.61) TSHRTP53SMN1; SMN2ALDH1A1CYP3A4
SCHEMBL11685267 0.82 ACP3 (0.43) ACP3TSHRTP53SMN1; SMN2ESR1
SCHEMBL4578515 0.81 TSHR (0.52) TSHRTP53SMN1; SMN2ALDH1A1CYP3A4
SCHEMBL28425046 0.81 ESR1 (0.57) SMN1; SMN2ALDH1A1ESR1ESR2POLB
SCHEMBL13991709 0.80 LMNA (0.50) ACP3ALDH1A1CYP3A4POLBPARP1
SCHEMBL23206357 0.77 TP53 (0.71) TSHRTP53SMN1; SMN2ALDH1A1POLB
SCHEMBL11587930 0.77 CES2 (0.67) ACP3SMN1; SMN2ALDH1A1CYP3A4POLB
SCHEMBL5523172 0.75 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1POLBMAPTMEN1
SCHEMBL891146 0.75 ESR1 (0.72) TSHRTP53SMN1; SMN2ALDH1A1CYP3A4
Benzoyl Peroxide SCHEMBL10925823 0.74 F2 (0.65) TSHRSMN1; SMN2ALDH1A1ESR1ESR2

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
EP-1472293-A4 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFINS, CATALYST COMPRISING THE SAME AND USE THEREOF CHINA PETROLEUM & CHEMICAL (CN) 2008-01-16 EP claimed
EP-1472293-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFINS, CATALYST COMPRISING THE SAME AND USE THEREOF China Petroleum & Chemical Corporation (CN) 2004-11-03 EP claimed
WO-2003068828-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFINS, CATALYST COMPRISING THE SAME AND USE THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2003-08-21 WO claimed
EP-1472293-A4 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFINS, CATALYST COMPRISING THE SAME AND USE THEREOF CHINA PETROLEUM & CHEMICAL (CN) 2008-01-16 EP disclosed
EP-1472293-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFINS, CATALYST COMPRISING THE SAME AND USE THEREOF China Petroleum & Chemical Corporation (CN) 2004-11-03 EP disclosed
WO-2003068828-A1 SOLID CATALYST COMPONENT FOR POLYMERIZATION OF OLEFINS, CATALYST COMPRISING THE SAME AND USE THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2003-08-21 WO disclosed