SCHEMBL7628025

SCHEMBL7628025

[CH2]CCCCCCCCCOOC(=O)c1ccc(OC)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.49
CA2 P00918 4/20 0.49
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
MAPT P10636 5/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HDAC8 Q9BY41 2/20 0.41
GSK3B P49841 1/20 0.41
GAA P10253 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41

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
SCHEMBL7623721 1.00 CA1 (0.49) CA1CA2NPC1RAB9ACES2
SCHEMBL7631214 1.00 CA1 (0.49) CA1CA2NPC1RAB9ACES2
SCHEMBL7627128 1.00 CA1 (0.49) CA1CA2NPC1RAB9ACES2
SCHEMBL7634594 1.00 CA1 (0.49) CA1CA2NPC1RAB9ACES2
SCHEMBL7633500 1.00 CA1 (0.49) CA1CA2NPC1RAB9ACES2
SCHEMBL7627432 1.00 CA1 (0.49) CA1CA2NPC1RAB9ACES2
SCHEMBL7631493 0.98 CA1 (0.50) CA1CA2NPC1RAB9ACES2
SCHEMBL7624327 0.94 CA1 (0.51) CA1CA2NPC1RAB9ACES2
SCHEMBL7629462 0.88 CA1 (0.55) CA1CA2NPC1RAB9ACES2
SCHEMBL7629384 0.86 ALDH1A1 (0.49) NPC1RAB9AMAPTGAAPARP10

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
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed