SCHEMBL9067643

SCHEMBL9067643

C=CCN(CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC)C(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.52
GAA P10253 1/20 0.52
HDAC1 Q13547 2/20 0.49
HDAC6 Q9UBN7 2/20 0.49
LSS P48449 2/20 0.46
HDAC3 O15379 1/20 0.46
HDAC2 Q92769 1/20 0.46
LTB4R2 Q9NPC1 1/20 0.46
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.45
CNR2 P34972 2/20 0.44

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
SCHEMBL4564020 0.99 HPGD (0.54) HPGDGAAHDAC1HDAC6LSS
Hydrochloric Acid SCHEMBL11640420 0.88 HPGD (0.44) HPGDGAAHDAC1HDAC6LSS
SCHEMBL8374583 0.86 HPGD (0.62) HPGDGAAHDAC1HDAC6HDAC3
SCHEMBL10695878 0.86 HPGD (0.62) HPGDGAAHDAC1HDAC6HDAC3
SCHEMBL8378738 0.86 HPGD (0.62) HPGDGAAHDAC1HDAC6HDAC3
SCHEMBL18274820 0.86 HPGD (0.62) HPGDGAAHDAC1HDAC6HDAC3
SCHEMBL6919327 0.82 HPGD (0.74) HPGDGAAHDAC1HDAC6HDAC3
SCHEMBL8089365 0.82 HPGD (0.62) HPGDGAAHDAC1HDAC6ALDH1A1
SCHEMBL176484 0.81 TSHR (0.53) HPGDHDAC1HDAC6HDAC3ALDH1A1
SCHEMBL4351824 0.81 HDAC1 (0.67) HPGDGAAHDAC1HDAC6HDAC3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5534174-A LUBRICANT ADDITIVE, DISPERSANT, VISCOSITY INDEX IMPROVER ETHYL PETROLEUM ADDITIVES, INC. (US) 1996-07-09 US disclosed
EP-0087234-B1 ASHLESS DISPERSANT COMPOUNDS, THEIR PREPARATION, AND THEIR USE IN PROVIDING DISPERSANCY IN LUBRICATING OILS OR LIQUID FUELS EDWIN COOPER INC. (US) 1986-11-12 EP disclosed
US-4519929-A ASHLESS DISPERSANTS; OIL AND FUEL ADDITIVES EDWIN COOPER, INC. (US) 1985-05-28 US disclosed
EP-0087234-A1 Ashless dispersant compounds, their preparation, and their use in providing dispersancy in lubricating oils or liquid fuels EDWIN COOPER INC. (US) 1983-08-31 EP disclosed