SCHEMBL8960701

SCHEMBL8960701

CCCCCCOC(=O)C(NCC)C(=O)NCC(=O)O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.42
EPHX1 P07099 1/20 0.41
EPHX2 P34913 2/20 0.41
ACHE P22303 6/20 0.41
FAAH O00519 1/20 0.40
NAAA Q02083 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 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
SCHEMBL9444232 0.75 ACHE (0.65) PLA2G2AEPHX1EPHX2ACHENPC1
SCHEMBL8576882 0.75 ACHE (0.65) PLA2G2AEPHX1EPHX2ACHENPC1
SCHEMBL8913848 0.75 ACHE (0.65) PLA2G2AEPHX1EPHX2ACHENPC1
SCHEMBL8849277 0.73 ACHE (0.61) EPHX1EPHX2ACHENPC1RAB9A
SCHEMBL11172758 0.72 PLA2G2A (0.49) PLA2G2AEPHX1EPHX2ACHEFAAH
SCHEMBL7166158 0.72 ALDH1A1 (0.42) PLA2G2AEPHX1ACHENAAAHCAR2
SCHEMBL8960640 0.70 ACHE (0.57) EPHX1EPHX2ACHEFAAHNPC1
SCHEMBL8960621 0.70 ACHE (0.57) EPHX1EPHX2ACHEFAAHNPC1
SCHEMBL8960685 0.70 ACHE (0.57) EPHX1EPHX2ACHEFAAHNPC1
SCHEMBL5258058 0.68 FAAH (0.57) PLA2G2AFAAH

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-0498729-B1 Dipeptide derivatives with urethan groupings, their preparation and their application, especially as hydratating agents and tensioactive agents in cosmetic, pharmaceutical and alimentary preparations OREAL (FR) 1996-01-31 EP claimed
EP-0498729-A1 Dipeptide derivatives with urethan groupings, their preparation and their application, especially as hydratating agents and tensioactive agents in cosmetic, pharmaceutical and alimentary preparations L'OREAL (FR) 1992-08-12 EP claimed
EP-0498729-B1 Dipeptide derivatives with urethan groupings, their preparation and their application, especially as hydratating agents and tensioactive agents in cosmetic, pharmaceutical and alimentary preparations OREAL (FR) 1996-01-31 EP disclosed
EP-0498729-A1 Dipeptide derivatives with urethan groupings, their preparation and their application, especially as hydratating agents and tensioactive agents in cosmetic, pharmaceutical and alimentary preparations L'OREAL (FR) 1992-08-12 EP disclosed