SCHEMBL8046927

SCHEMBL8046927

C=C(C)C(=O)OC.CC(C)=CCOC(=O)COc1ccc(C=CC=Cc2ccc(O)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.43
MAPT P10636 3/20 0.41
STAT3 P40763 1/20 0.40
BACE1 P56817 2/20 0.38
MAOB P27338 4/20 0.38
MEN1 O00255 1/20 0.38
NR1I2 O75469 1/20 0.38
LMNA P02545 1/20 0.38
PGR P06401 1/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
HPGD P15428 1/20 0.38
CNR1 P21554 1/20 0.38
TBXA2R P21731 1/20 0.38
SLC6A2 P23975 1/20 0.38
AGTR1 P30556 1/20 0.38
ADRA1A P35348 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38

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
SCHEMBL8046803 0.95 PPARG (0.40) PTGS2MAPTSTAT3BACE1ABCG2
SCHEMBL8035838 0.91 MAOB (0.40) PTGS2MAPTMAOBMEN1NR1I2
SCHEMBL8048204 0.91 NPSR1 (0.41) PTGS2MAPTSTAT3BACE1MAOB
SCHEMBL8045679 0.89 POLB (0.37) PTGS2MAPTSTAT3BACE1MAOB
SCHEMBL8053110 0.88 ABCG2 (0.44) MAPTBACE1MAOBMEN1NR1I2
Acrylic Acid Methyl Ester SCHEMBL8050149 0.88 PTGS2 (0.43) PTGS2MAPTSTAT3BACE1MAOB
SCHEMBL8045214 0.80 PTGS2 (0.42) PTGS2MAPTSTAT3BACE1MAOB
SCHEMBL8036026 0.78 CHRNB2 (0.38) MAPTBACE1MAOBMEN1NR1I2
SCHEMBL8045370 0.76 GAA (0.49) PTGS2MAPTMEN1NR1I2LMNA
SCHEMBL3843648 0.76 MEN1 (0.43) PTGS2MAPTSTAT3MAOBMEN1

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
US-6010826-A Resist composition NIPPON ZEON CO., LTD. (JP) 2000-01-04 US disclosed
EP-0786701-A1 RESIST COMPOSITION NIPPON ZEON CO., LTD. (JP) 1997-07-30 EP disclosed