SCHEMBL11039141

SCHEMBL11039141

CCCCCCCCN(CCCCCCCC)C(CC)(CC)C1CC(=O)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NPC1 O15118 1/20 0.36
ADH1C P00326 1/20 0.30
ADH1A P07327 1/20 0.30
ADH4 P08319 1/20 0.30
LMNA P02545 2/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL24943449 0.74 ALDH1A1 (0.39) ALDH1A1L3MBTL1NPC1LMNAKDM4E
SCHEMBL10587757 0.71 ALDH1A1 (0.42) ALDH1A1L3MBTL1NPC1ADH1CADH1A
SCHEMBL22146994 0.69 NPC1 (0.41) ALDH1A1L3MBTL1NPC1LMNAKDM4E
SCHEMBL18515841 0.68 MAP3K14 (0.39) ALDH1A1L3MBTL1NPC1LMNA
SCHEMBL16682230 0.68 CRBN (0.41) ALDH1A1L3MBTL1NPC1LMNA
SCHEMBL11727127 0.66 ALDH1A1 (0.54) ALDH1A1L3MBTL1NPC1LMNAKDM4E
SCHEMBL8697031 0.66 ALDH1A1 (0.54) ALDH1A1L3MBTL1NPC1LMNAKDM4E
SCHEMBL734754 0.66 ALDH1A1 (0.54) ALDH1A1L3MBTL1NPC1LMNAKDM4E
SCHEMBL734158 0.66 ALDH1A1 (0.54) ALDH1A1L3MBTL1NPC1LMNAKDM4E
SCHEMBL5617175 0.66 ALDH1A1 (0.54) ALDH1A1L3MBTL1NPC1LMNAKDM4E

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-0066241-B1 MODIFIED CIS-1,4-POLYISOPRENE RUBBER, A PROCESS FOR ITS MANUFACTURE, A VULCANIZED MODIFIED CIS-1,4-POLYISOPRENE RUBBER COMPOSITION AND THE USE OF THE MODIFIED CIS-1,4-POLYISOPRENE RUBBER FOR PREPARING VULCANIZED SHAPED ARTICLES KURARAY CO., LTD. (JP) 1985-05-08 EP disclosed