SCHEMBL7741780

SCHEMBL7741780

CC(O)OC(C(=O)c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.48
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
PGR P06401 1/20 0.46
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
HTR2A P28223 1/20 0.46
HRH1 P35367 1/20 0.46
KCNH2 Q12809 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
ALDH1A1 P00352 3/20 0.44
CYP3A4 P08684 2/20 0.44
TSHR P16473 3/20 0.42
ALKBH5 Q6P6C2 1/20 0.42
MAPT P10636 4/20 0.41
POLB P06746 1/20 0.41
PARP1 P09874 1/20 0.41
CYP2C19 P33261 1/20 0.41
RECQL P46063 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
SCHEMBL25419171 0.84 LMNA (0.48) LMNACES2CES1PGRADRA2A
Benzoin SCHEMBL8203502 0.79 LMNA (0.75) LMNACES2CES1PGRADRA2A
SCHEMBL27680569 0.78 TSHR (0.53) LMNACES2CES1PGRADRA2A
SCHEMBL5424308 0.77 MAPT (0.50) LMNACES2CES1PGRADRA2A
SCHEMBL146504 0.77 TSHR (0.52) LMNACES2CES1PGRADRA2A
SCHEMBL27003 0.76 LMNA (0.58) LMNACES2CES1PGRADRA2A
SCHEMBL1093883 0.76 LMNA (0.58) LMNACES2CES1PGRADRA2A
SCHEMBL1820544 0.76 LMNA (0.58) LMNACES2CES1PGRADRA2A
SCHEMBL25382942 0.76 TDP1 (0.54) LMNACES2CES1PGRADRA2A
SCHEMBL29870755 0.76 ALDH1A1 (0.49) LMNACES2CES1PGRADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-H2043-H1 CONTAINING RETINOIDS THE PROCTER & GAMBLE COMPANY 2002-08-06 US disclosed