SCHEMBL9444232

SCHEMBL9444232

CCCCCCCCCCCCOC(=O)NCC(=O)O

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACHE P22303 13/20 0.65
EPHX1 P07099 1/20 0.61
EPHX2 P34913 2/20 0.60
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PLA2G2A P14555 1/20 0.51

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
SCHEMBL8576882 1.00 ACHE (0.65) ACHEEPHX1EPHX2NPC1RAB9A
SCHEMBL8913848 1.00 ACHE (0.65) ACHEEPHX1EPHX2NPC1RAB9A
SCHEMBL8849277 0.98 ACHE (0.61) ACHEEPHX1EPHX2NPC1RAB9A
SCHEMBL8960685 0.93 ACHE (0.57) ACHEEPHX1EPHX2NPC1RAB9A
SCHEMBL8960640 0.93 ACHE (0.57) ACHEEPHX1EPHX2NPC1RAB9A
SCHEMBL8960621 0.93 ACHE (0.57) ACHEEPHX1EPHX2NPC1RAB9A
SCHEMBL461365 0.92 ACHE (0.58) ACHEEPHX1EPHX2
Hydrochloric Acid SCHEMBL2185194 0.91 ACHE (0.56) ACHEEPHX1EPHX2
SCHEMBL4751426 0.86 ACHE (0.51) ACHEEPHX1EPHX2
SCHEMBL13153845 0.84 ACHE (0.50) ACHEEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5230890-A URETHANE DERIVATIVES FROM AMINO ACIDS, A PROCESS FOR THEIR PREPARATION AND COSMETIC OR PHARMACEUTICAL COMPOSITIONS FOR USE IN THE TREATMENT OF DRY SKIN L'OREAL (FR) 1993-07-27 US disclosed
EP-0408448-B1 URETHANE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS HUMECTANTS IN COSMETIC AND PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF DRY SKIN L'OREAL (FR) 1993-05-05 EP disclosed
EP-0408448-A1 Urethane derivatives, their preparation and their use as humectants in cosmetic and pharmaceutical compositions for the treatment of dry skin L'OREAL (FR) 1991-01-16 EP disclosed