SCHEMBL6137896

SCHEMBL6137896

O=C(O)CNC(=O)CC1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.56
NPC1 O15118 4/20 0.56
HPGD P15428 3/20 0.55
KMT2A Q03164 2/20 0.55
EPHX1 P07099 1/20 0.55
EPHX2 P34913 2/20 0.53
KEAP1 Q14145 2/20 0.50
NFE2L2 Q16236 2/20 0.50
POLB P06746 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ITGB1 P05556 1/20 0.47
ITGA5 P08648 1/20 0.47
ERCC1 P07992 1/20 0.46
ERCC4 Q92889 1/20 0.46
RECQL P46063 1/20 0.45

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
SCHEMBL13546279 0.98 RAB9A (0.53) RAB9ANPC1HPGDKMT2AEPHX1
SCHEMBL6273913 0.84 RAB9A (0.49) RAB9ANPC1HPGDKMT2AEPHX1
SCHEMBL6274645 0.82 HPGD (0.53) RAB9ANPC1HPGDKMT2AEPHX1
SCHEMBL11356392 0.82 HPGD (0.53) RAB9ANPC1HPGDKMT2AEPHX1
SCHEMBL8244324 0.82 HPGD (0.53) RAB9ANPC1HPGDKMT2AEPHX1
SCHEMBL6272365 0.82 RAB9A (0.46) RAB9ANPC1HPGDKMT2AEPHX1
SCHEMBL6268150 0.80 HPGD (0.50) RAB9ANPC1HPGDKMT2AEPHX1
SCHEMBL20798235 0.78 ITGB1 (0.42) RAB9ANPC1HPGDKMT2AEPHX1
SCHEMBL10403725 0.78 GLA (0.48) RAB9ANPC1HPGDKMT2A
SCHEMBL658991 0.78 HPGD (0.57) RAB9ANPC1HPGDKMT2AEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1047391-A4 ALPHA-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS GILLETTE CO (US) 2005-01-19 EP claimed
US-6238655-B1 USEFUL IN THE FORMULATION OF DEODORANTS, ANTIPERSPIRANTS, BODY SPRAYS, AND OTHER SKIN TREATMENT COMPOSITIONS. THE GILLETTE COMPANY 2001-05-29 US claimed
EP-1047391-A1 ALPHA-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS THE GILLETTE COMPANY (US) 2000-11-02 EP claimed
WO-1999030679-A1 α-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS THE GILLETTE COMPANY (US) 1999-06-24 WO claimed
EP-1047391-A4 ALPHA-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS GILLETTE CO (US) 2005-01-19 EP disclosed
US-6238655-B1 USEFUL IN THE FORMULATION OF DEODORANTS, ANTIPERSPIRANTS, BODY SPRAYS, AND OTHER SKIN TREATMENT COMPOSITIONS. THE GILLETTE COMPANY 2001-05-29 US disclosed
EP-1047391-A1 ALPHA-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS THE GILLETTE COMPANY (US) 2000-11-02 EP disclosed
WO-1999030679-A1 α-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS THE GILLETTE COMPANY (US) 1999-06-24 WO disclosed
US-4267174-A AND PROCESS FOR ADMINISTERING BOEHRINGER MANNHEIM, GMBH (DE) 1981-05-12 US disclosed