SCHEMBL5280595

SCHEMBL5280595

NC(CC(=O)NC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 7/20 0.54
SLC1A3 P43003 6/20 0.54
SLC1A1 P43005 6/20 0.54
ALDH1A1 P00352 2/20 0.49
TPH1 P17752 2/20 0.47
SLC7A5 Q01650 2/20 0.47
ALPI P09923 1/20 0.46
PKM P14618 1/20 0.46
PTGS1 P23219 1/20 0.46
XIAP P98170 1/20 0.46
LTA4H P09960 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
CYP1A2 P05177 1/20 0.45
GAA P10253 1/20 0.44

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
SCHEMBL6535411 0.83 LTA4H (0.57) SLC1A2SLC1A1ALDH1A1TPH1LTA4H
SCHEMBL27827515 0.81 ALDH1A1 (0.47) SLC1A2ALDH1A1SMN1; SMN2CYP1A2GAA
SCHEMBL16145001 0.79 KDM4E (0.51) SLC1A2SLC1A3SLC1A1ALDH1A1SLC7A5
SCHEMBL5277273 0.78 SLC1A1 (0.57) SLC1A2SLC1A3SLC1A1SLC7A5ALPI
SCHEMBL8013551 0.76 ALDH1A1 (0.49) SLC1A2ALDH1A1LTA4HSMN1; SMN2CYP1A2
SCHEMBL27995563 0.76 ALDH1A1 (0.49) SLC1A2ALDH1A1LTA4HSMN1; SMN2CYP1A2
SCHEMBL7799557 0.76 TSHR (0.64) SLC1A2SLC1A3SLC1A1ALDH1A1SLC7A5
SCHEMBL7699974 0.76 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2CYP1A2GAA
SCHEMBL2791083 0.76 TSHR (0.64) SLC1A2SLC1A3SLC1A1ALDH1A1SLC7A5
SCHEMBL2860324 0.76 TSHR (0.64) SLC1A2SLC1A3SLC1A1ALDH1A1SLC7A5

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 7 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
EP-1052968-A4 $g(a)-AMIDES OF $i(L)-AMINO ACIDS AS FRAGRANCE PRECURSORS GILLETTE CO (US) 2004-09-15 EP disclosed
EP-1052968-A1 $g(a)-AMIDES OF $i(L)-AMINO ACIDS AS FRAGRANCE PRECURSORS THE GILLETTE COMPANY (US) 2000-11-22 EP disclosed
US-5932198-A α-amides of L-amino acids as fragrance precursors THE GILLETTE COMPANY (US) 1999-08-03 US disclosed
WO-1999030680-A1 α-AMIDES OF L-AMINO ACIDS AS FRAGRANCE PRECURSORS THE GILLETTE COMPANY (US) 1999-06-24 WO disclosed