SCHEMBL31661878

SCHEMBL31661878

O=C(O)CCCCCCCCC(=O)c1ccccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.61
HDAC4 P56524 2/20 0.61
HDAC1 Q13547 2/20 0.61
HDAC7 Q8WUI4 2/20 0.61
HDAC2 Q92769 2/20 0.61
HDAC10 Q969S8 2/20 0.61
HDAC11 Q96DB2 2/20 0.61
HDAC8 Q9BY41 2/20 0.61
HDAC6 Q9UBN7 2/20 0.61
HDAC9 Q9UKV0 2/20 0.61
HDAC5 Q9UQL6 2/20 0.61
CYP19A1 P11511 1/20 0.53
MAPT P10636 4/20 0.52
L3MBTL1 Q9Y468 2/20 0.52
LMNA P02545 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
HPGD P15428 2/20 0.50
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50

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
SCHEMBL29164312 1.00 HDAC3 (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1114801 1.00 HDAC3 (0.61) HDAC3HDAC4HDAC1HDAC7HDAC2
Ammonia Solution, Strong SCHEMBL12819153 0.98 HDAC3 (0.59) HDAC3HDAC4HDAC1HDAC7HDAC2
Ammonia Solution, Strong SCHEMBL12818623 0.98 HDAC3 (0.59) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9077857 0.98 HDAC3 (0.58) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8519711 0.92 CYP19A1 (0.59) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8672674 0.92 CYP19A1 (0.59) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL8670350 0.92 CYP19A1 (0.59) HDAC3HDAC4HDAC1HDAC7HDAC2
Phenol SCHEMBL9396776 0.89 CYP19A1 (0.62) HDAC3HDAC4HDAC1HDAC7HDAC2
Sebacic Acid SCHEMBL9136782 0.87 ALDH1A1 (0.69) HDAC3HDAC4HDAC1HDAC7HDAC2

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-2025151884-A1 USE OF GLYCOSAMINOGLYCAN SULFATED POLYSACCHARIDES SUCH AS SODIUM PENTOSAN POLYSULFATE IN COMBINATION WITH PERMEATION AGENTS TO TREAT ALZHEIMER'S DISEASE PARSONS C LOWELL (US) 2025-07-17 WO disclosed