SCHEMBL10334302

SCHEMBL10334302

COc1ccc(OC(=O)C(OC)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.49
HTT P42858 2/20 0.49
ALDH1A1 P00352 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
NPY2R P49146 1/20 0.46
ELANE P08246 3/20 0.45
KCNN4 O15554 1/20 0.44
KIF11 P52732 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
TAAR1 Q96RJ0 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
BACE1 P56817 1/20 0.42
CA4 P22748 1/20 0.42
MAPT P10636 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
SCHEMBL3910744 0.91 KCNN4 (0.48) GAAHTTALDH1A1SMN1; SMN2CES1
SCHEMBL10335681 0.89 LMNA (0.46) GAAALDH1A1CES1ELANEKCNN4
SCHEMBL10335662 0.87 ELANE (0.49) HTTSMN1; SMN2CES1ELANEKCNN4
SCHEMBL10334900 0.86 LMNA (0.46) SMN1; SMN2CES2CES1KCNN4NPC1
SCHEMBL10334716 0.82 ALDH1A1 (0.52) GAAALDH1A1SMN1; SMN2CES2CES1
SCHEMBL10334682 0.80 ATM (0.49) HTTALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL18648452 0.80 ALDH1A1 (0.49) GAAHTTALDH1A1SMN1; SMN2CES2
SCHEMBL10335589 0.80 POLB (0.45) GAAHTTALDH1A1SMN1; SMN2CES1
SCHEMBL9292596 0.79 MAPT (0.50) GAAALDH1A1SMN1; SMN2CES2CES1
SCHEMBL10334916 0.78 LMNA (0.53) GAAALDH1A1SMN1; SMN2KCNN4MEN1

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-4964893-A REDUCING INJURY TO A CROP PLANT MONSANTO COMPANY (US) 1990-10-23 US disclosed