SCHEMBL9811252

SCHEMBL9811252

COc1ccc(COC(=O)N[C@H]2CNNC2=O)cc1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 16/20 0.60
ASAH1 Q13510 3/20 0.60
ALDH1A1 P00352 1/20 0.49
PKM P14618 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MMP1 P03956 1/20 0.45
MMP9 P14780 1/20 0.45

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
SCHEMBL9811247 1.00 NAAA (0.60) NAAAASAH1ALDH1A1PKMHTT
SCHEMBL9811242 1.00 NAAA (0.60) NAAAASAH1ALDH1A1PKMHTT
SCHEMBL9811485 0.85 NAAA (0.65) NAAAASAH1ALDH1A1
SCHEMBL9811492 0.85 NAAA (0.65) NAAAASAH1ALDH1A1
SCHEMBL9811239 0.81 NAAA (0.54) NAAAASAH1
SCHEMBL9811243 0.81 NAAA (0.54) NAAAASAH1
SCHEMBL9811249 0.81 NAAA (0.54) NAAAASAH1
SCHEMBL28285545 0.76 SMN1; SMN2 (0.70) ALDH1A1PKMHTTSMN1; SMN2
SCHEMBL8604102 0.76 NAAA (0.73) NAAAASAH1
SCHEMBL1072079 0.76 ALDH1A1 (0.49) NAAAASAH1ALDH1A1PKMHTT

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-0202795-B1 4-SUBSTITUTED DIAZOLIDINONES ELI LILLY AND COMPANY (US) 1991-06-12 EP disclosed
US-4826993-A Substituted diazolidinones ELI LILLY AND COMPANY (US) 1989-05-02 US disclosed
EP-0202795-A1 4-Substituted diazolidinones ELI LILLY AND COMPANY (US) 1986-11-26 EP disclosed