SCHEMBL29315575

SCHEMBL29315575

C=C(C)C(=O)OCCCCC(=O)Nc1ccccc1-c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 2/20 0.62
HDAC3 O15379 2/20 0.55
HDAC4 P56524 2/20 0.55
HDAC1 Q13547 2/20 0.55
HDAC7 Q8WUI4 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC10 Q969S8 2/20 0.55
HDAC11 Q96DB2 2/20 0.55
HDAC8 Q9BY41 2/20 0.55
HDAC6 Q9UBN7 2/20 0.55
HDAC9 Q9UKV0 2/20 0.55
HDAC5 Q9UQL6 2/20 0.55
ALDH1A1 P00352 7/20 0.47
HTT P42858 3/20 0.47
NPY1R P25929 1/20 0.47
NPY2R P49146 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.46
MAPT P10636 4/20 0.46
NPC1 O15118 2/20 0.46

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
SCHEMBL29315576 0.99 SOAT1 (0.64) SOAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL29315578 0.99 SOAT1 (0.64) SOAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL29315569 0.91 SOAT1 (0.55) SOAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL29316040 0.83 HDAC1 (0.58) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL19713012 0.83 CHRM3 (0.54) ALDH1A1NPY1RNPY2R
SCHEMBL29316042 0.82 HDAC1 (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29316044 0.82 HDAC1 (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29315479 0.82 SOAT1 (0.60) SOAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL29315481 0.81 SOAT1 (0.62) SOAT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL29315483 0.81 SOAT1 (0.62) SOAT1HDAC3HDAC4HDAC1HDAC7

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