SCHEMBL7501972

SCHEMBL7501972

[NH]C(=O)OCc1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.49
MMP2 P08253 1/20 0.49
MMP9 P14780 1/20 0.49
MMP12 P39900 1/20 0.49
IDO1 P14902 2/20 0.48
AGXT P21549 2/20 0.48
NR4A2 P43354 2/20 0.47
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
LMNA P02545 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
FABP7 O15540 1/20 0.46
FABP5 Q01469 1/20 0.46
MAOB P27338 3/20 0.46
PARP10 Q53GL7 1/20 0.46
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL6554287 0.83 IDO1 (0.52) MMP1MMP2MMP9MMP12IDO1
SCHEMBL1788919 0.83 KDM4E (0.53) MMP1MMP2MMP9MMP12IDO1
SCHEMBL1788921 0.81 NR4A2 (0.53) MMP1MMP2MMP9MMP12IDO1
SCHEMBL136005 0.79 ALDH1A1 (0.64) MMP1MMP2MMP9MMP12IDO1
SCHEMBL29270279 0.79 MMP1 (0.49) MMP1MMP2MMP9MMP12IDO1
SCHEMBL498363 0.79 ALDH1A1 (0.49) MMP1MMP2MMP9MMP12IDO1
SCHEMBL5360275 0.79 ALDH1A1 (0.64) MMP1MMP2MMP9MMP12IDO1
SCHEMBL2297633 0.79 MMP2 (0.49) MMP1MMP2MMP9MMP12AGXT
SCHEMBL5762294 0.79 MAOB (0.54) MMP1MMP2MMP9MMP12IDO1
SCHEMBL6176885 0.79 KMT2A (0.54) MMP1IDO1MAPTKDM4EMEN1

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-0826673-B1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO (JP) 2002-11-20 EP disclosed
US-5972946-A NERVOUS SYSTEM DISORDERS; PSYCHOLOGICAL DISORDERS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1999-10-26 US disclosed
EP-0826673-A1 ACETAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-03-04 EP disclosed