SCHEMBL9829396

SCHEMBL9829396

CCCCCOC(=O)N[C@@](C)(CO)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.50
ACHE P22303 14/20 0.45
NAAA Q02083 1/20 0.41
HCAR2 Q8TDS4 1/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL9829390 1.00 EPHX1 (0.50) EPHX1ACHENAAAHCAR2NPC1
SCHEMBL5201837 0.95 EPHX1 (0.43) EPHX1ACHEHCAR2RAB9A
SCHEMBL3400195 0.82 EPHX1 (0.43) EPHX1ACHEHCAR2
SCHEMBL9030664 0.81 EPHX1 (0.42) EPHX1ACHEHCAR2NPC1RAB9A
SCHEMBL21059108 0.79 EPHX1 (0.60) EPHX1ACHENAAA
SCHEMBL19548070 0.78 FPR2 (0.41) EPHX1ACHEHCAR2NPC1RAB9A
SCHEMBL11523990 0.78 EPHX1 (0.59) EPHX1ACHENAAAHCAR2NPC1
SCHEMBL21059244 0.78 EPHX1 (0.63) EPHX1ACHENAAA
SCHEMBL27577278 0.78 EPHX1 (0.63) EPHX1ACHENAAA
SCHEMBL7368744 0.77 EPHX1 (0.44) EPHX1ACHEHCAR2NPC1RAB9A

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
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed