SCHEMBL6136289

SCHEMBL6136289

CC(NC(=O)CC1CCCCC1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.55
HPGD P15428 2/20 0.50
EPHX1 P07099 1/20 0.50
KMT2A Q03164 1/20 0.50
EPHX2 P34913 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
PSEN1 P49768 2/20 0.41
PSEN2 P49810 2/20 0.41
APH1B Q8WW43 2/20 0.41
NCSTN Q92542 2/20 0.41
APH1A Q96BI3 2/20 0.41
PSENEN Q9NZ42 2/20 0.41
POLB P06746 1/20 0.40
P2RX7 Q99572 1/20 0.40
CTSD P07339 1/20 0.39
CTSK P43235 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
SCHEMBL6136293 1.00 LTA4H (0.55) LTA4HHPGDEPHX1KMT2AEPHX2
SCHEMBL6136574 0.98 LTA4H (0.52) LTA4HHPGDEPHX1KMT2AEPHX2
SCHEMBL4414768 0.98 LTA4H (0.52) LTA4HHPGDEPHX1KMT2AEPHX2
SCHEMBL4424684 0.91 SMN1; SMN2 (0.49) LTA4HEPHX1SMN1; SMN2RAB9APOLB
SCHEMBL6136421 0.91 SMN1; SMN2 (0.49) LTA4HEPHX1SMN1; SMN2RAB9APOLB
SCHEMBL7437533 0.85 HPGD (0.57) LTA4HHPGDEPHX1KMT2AEPHX2
SCHEMBL11357838 0.83 ALDH1A1 (0.53) LTA4HHPGDEPHX1KMT2AEPHX2
SCHEMBL7882899 0.83 KMT2A (0.53) HPGDEPHX1KMT2AEPHX2SMN1; SMN2
SCHEMBL6138081 0.81 HPGD (0.46) LTA4HHPGDEPHX1KMT2AEPHX2
SCHEMBL6138080 0.81 HPGD (0.46) LTA4HHPGDEPHX1KMT2AEPHX2

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-0951464-B1 N-(ARYL/HETEROARYLACETYL) AMINO ACID ESTERS, PHARMACEUTICAL COMPOSITIONS COMPRISING SAME, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS BY USE OF SUCH COMPOUNDS ELAN PHARM INC (US) 2005-05-11 EP claimed
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