SCHEMBL31682018

SCHEMBL31682018

O=C(O)CCCCCCCCCCCCCCCc1ccc(S(=O)(=O)Nc2ccc(C(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)O)cn2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HDAC1 Q13547 6/20 0.38
HDAC3 O15379 5/20 0.38
HDAC4 P56524 5/20 0.38
HDAC7 Q8WUI4 5/20 0.38
HDAC2 Q92769 5/20 0.38
HDAC10 Q969S8 5/20 0.38
HDAC11 Q96DB2 5/20 0.38
HDAC8 Q9BY41 5/20 0.38
HDAC6 Q9UBN7 5/20 0.38
HDAC9 Q9UKV0 5/20 0.38
HDAC5 Q9UQL6 5/20 0.38
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
PKM P14618 2/20 0.36
NAMPT P43490 1/20 0.36
CA1 P00915 1/20 0.36

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
SCHEMBL22080240 1.00 CA2 (0.39) CA2NPC1RAB9AHDAC1HDAC3
SCHEMBL22080457 1.00 CA2 (0.39) CA2NPC1RAB9AHDAC1HDAC3
SCHEMBL31682061 1.00 CA2 (0.39) CA2NPC1RAB9AHDAC1HDAC3
SCHEMBL31681987 1.00 CA2 (0.39) CA2NPC1RAB9AHDAC1HDAC3
SCHEMBL31682102 1.00 CA2 (0.39) CA2NPC1RAB9AHDAC1HDAC3
SCHEMBL24257936 1.00 CA2 (0.39) CA2NPC1RAB9AHDAC1HDAC3
SCHEMBL22080215 1.00 CA2 (0.39) CA2NPC1RAB9AHDAC1HDAC3
SCHEMBL22080208 0.96 HDAC3 (0.39) CA2NPC1RAB9AHDAC1HDAC3
SCHEMBL22080228 0.96 HDAC3 (0.39) CA2NPC1RAB9AHDAC1HDAC3
SCHEMBL31681969 0.96 HDAC3 (0.39) CA2NPC1RAB9AHDAC1HDAC3

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-3893934-B1 INSULIN CONJUGATES SANOFI SA (FR) 2025-09-10 EP disclosed