SCHEMBL7559902

SCHEMBL7559902

O=C(OC(=O)C(O)(c1ccccc1)c1ccccc1)[C@H](O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.46
CHRM3 P20309 4/20 0.46
CHRM2 P08172 4/20 0.46
CHRM1 P11229 4/20 0.46
MAPK1 P28482 1/20 0.46
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
CHRM4 P08173 2/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.39
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CHRM5 P08912 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
SCHEMBL28230035 0.81 CHRM3 (0.54) LMNACHRM3CHRM2CHRM1MEN1
SCHEMBL1670874 0.80 CES2 (0.45) CHRM3CHRM2CHRM1MEN1POLB
SCHEMBL1951103 0.80 LMNA (0.62) LMNACHRM3CHRM2CHRM1MAPK1
SCHEMBL352390 0.80 LMNA (0.62) LMNACHRM3CHRM2CHRM1MAPK1
SCHEMBL11878020 0.80 CHRM3 (0.49) LMNACHRM3CHRM2CHRM1MEN1
SCHEMBL7564702 0.76 MEN1 (0.46) LMNACHRM3CHRM2CHRM1MAPK1
SCHEMBL2687707 0.76 LMNA (0.58) LMNACHRM3CHRM2CHRM1MAPK1
SCHEMBL11421308 0.74 KCNN4 (0.37) LMNAMAPK1MEN1KMT2ACES2
Benzylic Acid SCHEMBL7559896 0.74 LMNA (0.67) LMNAMAPK1CNR1CNR2CES2
SCHEMBL9663474 0.73 LMNA (0.50) LMNACHRM3CHRM2CHRM1MAPK1

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
WO-2002067890-A2 METHOD AND PRODUCT FOR SKIN LIGHTENING UNILEVER PLC (GB) 2002-09-06 WO disclosed