SCHEMBL8638618

SCHEMBL8638618

CC(=O)/N=C1/N(Nc2ccccc2)C(=O)OC1(C)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.36
MMP9 P14780 3/20 0.36
MMP3 P08254 1/20 0.36
MMP8 P22894 1/20 0.36
MMP13 P45452 1/20 0.36
MMP1 P03956 1/20 0.36
ADAM17 P78536 1/20 0.36
RECQL P46063 1/20 0.36
HPGD P15428 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
EPHX1 P07099 1/20 0.34
NAAA Q02083 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
PGR P06401 1/20 0.33
MAPT P10636 3/20 0.32

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
SCHEMBL8638621 1.00 MMP2 (0.36) MMP2MMP9MMP3MMP8MMP13
SCHEMBL8651881 0.92 SMN1; SMN2 (0.36) MMP2MMP9MMP3MMP8MMP13
SCHEMBL8651884 0.92 SMN1; SMN2 (0.36) MMP2MMP9MMP3MMP8MMP13
Famoxadone SCHEMBL673443 0.83 MMP2 (0.42) MMP2MMP9MMP3MMP8MMP13
Famoxadone SCHEMBL14128616 0.83 MMP2 (0.42) MMP2MMP9MMP3MMP8MMP13
Famoxadone SCHEMBL63351 0.83 MMP2 (0.42) MMP2MMP9MMP3MMP8MMP13
Famoxadone SCHEMBL28139781 0.82 MMP1 (0.40) MMP2MMP9MMP3MMP8MMP13
Famoxadone SCHEMBL17293878 0.82 MMP2 (0.41) MMP2MMP9MMP3MMP8MMP13
SCHEMBL8637040 0.81 MMP2 (0.40) MMP2MMP9MMP3MMP8MMP13
Bromide SCHEMBL9321448 0.80 MMP2 (0.39) MMP2MMP9MMP3MMP8MMP13

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-0577712-B1 FUNGICIDAL 4-THIOXOOXAZOLIDIN-2-ONES AND 4-IMINOOXAZOLINDIN-2-ONES DU PONT (US) 1998-07-29 EP disclosed
EP-0577712-A1 FUNGICIDAL 4-THIOXOOXAZOLIDIN-2-ONES AND 4-IMINOOXAZOLINDIN-2-ONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1994-01-12 EP disclosed
WO-1992016515-A1 FUNGICIDAL 4-THIOXOOXAZOLIDIN-2-ONES AND 4-IMINOOXAZOLINDIN-2-ONES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-10-01 WO disclosed
EP-0503798-A1 Fungicidal 4-thixooxazolidin-2-ones and 4-iminooxazolindin-2-ones E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-09-16 EP disclosed