SCHEMBL26048815

SCHEMBL26048815

C=CC(=O)OCCOc1ccc(C(C)(C)c2ccc(C(C)(C)OCC)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.53
KDM4E B2RXH2 10/20 0.44
ALDH1A1 P00352 7/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
GAA P10253 2/20 0.43
POLB P06746 2/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
HTT P42858 2/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
LMNA P02545 2/20 0.38
TDP1 Q9NUW8 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
SCHEMBL21779001 0.90 THRB (0.58) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL137572 0.90 THRB (0.65) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL14173110 0.90 THRB (0.65) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL23607007 0.86 THRB (0.55) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL12726674 0.86 THRB (0.57) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL7631129 0.86 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL20394042 0.86 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL12281676 0.86 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL19770675 0.86 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL16804047 0.86 THRB (0.60) THRBKDM4EALDH1A1SMN1; SMN2GAA

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-11745302-B2 Methods and precursor formulations for forming advanced polishing pads by use of an additive manufacturing process APPLIED MATERIALS, INC. (US) 2023-09-05 US disclosed