SCHEMBL29315465

SCHEMBL29315465

C=CC(=O)OCCCOC(=O)Oc1ccccc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.47
KMT2A Q03164 2/20 0.44
GAA P10253 1/20 0.44
HTT P42858 3/20 0.43
ALDH1A1 P00352 5/20 0.42
TSHR P16473 3/20 0.42
CYP3A4 P08684 1/20 0.42
ELANE P08246 1/20 0.42
KDM4E B2RXH2 5/20 0.40
USP2 O75604 1/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
FABP7 O15540 1/20 0.39
FABP3 P05413 1/20 0.39
FABP5 Q01469 1/20 0.39
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39

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
SCHEMBL29315467 0.97 KMT2A (0.47) THRBKMT2AGAAHTTALDH1A1
SCHEMBL29315469 0.96 ALDH1A1 (0.49) THRBKMT2AGAAHTTALDH1A1
SCHEMBL29315471 0.96 ALDH1A1 (0.49) THRBKMT2AGAAHTTALDH1A1
SCHEMBL29315464 0.95 THRB (0.52) THRBKMT2AGAAHTTALDH1A1
SCHEMBL10709553 0.88 KMT2A (0.56) THRBKMT2AGAAHTTALDH1A1
SCHEMBL29315447 0.86 THRB (0.46) THRBKMT2AGAAHTTALDH1A1
SCHEMBL17723354 0.85 KMT2A (0.60) THRBKMT2AGAAHTTALDH1A1
SCHEMBL29315452 0.85 KMT2A (0.46) THRBKMT2AGAAHTTALDH1A1
SCHEMBL25123653 0.84 USP2 (0.54) THRBKMT2AGAAHTTALDH1A1
SCHEMBL29315438 0.84 KMT2A (0.58) THRBKMT2AGAAHTTALDH1A1

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-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed
US-20240239934-A1 FUMARIC ACID DIESTER RESIN, FILM AND POLARIZING PLATE TOSOH CORPORATION (JP) 2024-07-18 US disclosed