SCHEMBL5322759

SCHEMBL5322759

NC(=O)CC(NC(=O)C1CCCCC1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 2/20 0.42
LMNA P02545 2/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CHRNB2 P17787 4/20 0.40
CHRNB4 P30926 4/20 0.40
CHRNA3 P32297 4/20 0.40
CHRNA4 P43681 4/20 0.40
GRIN1 Q05586 1/20 0.40
GRIN2A Q12879 1/20 0.40
GRM1 Q13255 1/20 0.40
ITGB2 P05107 2/20 0.40
ICAM1 P05362 2/20 0.40
ITGAL P20701 2/20 0.40
PADI1 Q9ULC6 1/20 0.40
PADI4 Q9UM07 1/20 0.40
EPHX1 P07099 1/20 0.40
HTR1A P08908 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL1075861 1.00 ECE1 (0.42) ECE1LMNAHDAC8HDAC6CHRNB2
SCHEMBL7898517 0.86 MME (0.46) LMNAHDAC8HDAC6PADI1PADI4
SCHEMBL23967395 0.86 MME (0.46) LMNAHDAC8HDAC6PADI1PADI4
SCHEMBL28910144 0.85 MME (0.45) LMNAHDAC8HDAC6PADI1PADI4
SCHEMBL5322256 0.84 KMT2A (0.43) LMNAHDAC8HDAC6CHRNB2CHRNB4
SCHEMBL5322259 0.84 KMT2A (0.43) LMNAHDAC8HDAC6CHRNB2CHRNB4
SCHEMBL2795524 0.81 HDAC8 (0.45) LMNAHDAC8HDAC6CHRNB2CHRNB4
SCHEMBL2794690 0.81 HDAC8 (0.45) LMNAHDAC8HDAC6CHRNB2CHRNB4
SCHEMBL2797000 0.81 HDAC8 (0.45) LMNAHDAC8HDAC6CHRNB2CHRNB4
SCHEMBL10809124 0.81 PADI1 (0.47) LMNAHDAC8HDAC6PADI1PADI4

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
EP-1052968-B1 ALPHA-AMIDES OF(L)-AMINO ACIDS AS FRAGRANCE PRECURSORS GILLETTE CO (US) 2007-12-05 EP claimed
US-5932198-A α-amides of L-amino acids as fragrance precursors THE GILLETTE COMPANY (US) 1999-08-03 US claimed
EP-1052968-B1 ALPHA-AMIDES OF(L)-AMINO ACIDS AS FRAGRANCE PRECURSORS GILLETTE CO (US) 2007-12-05 EP disclosed
US-5932198-A α-amides of L-amino acids as fragrance precursors THE GILLETTE COMPANY (US) 1999-08-03 US disclosed