SCHEMBL3720430

SCHEMBL3720430

CCCC(=O)OCc1ccc(F)cc1F

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.50
IDO1 P14902 2/20 0.49
AGXT P21549 2/20 0.49
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 1/20 0.46
GSK3B P49841 2/20 0.43
BACE1 P56817 2/20 0.43
RIPK1 Q13546 2/20 0.43
PTGER1 P34995 1/20 0.41
PDE10A Q9Y233 1/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MAPT P10636 2/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL721553 0.87 MAOB (0.52) MAOBIDO1AGXTALDH1A1TDP1
SCHEMBL28220495 0.82 MMP2 (0.44) ALDH1A1
SCHEMBL13034123 0.80 MAOB (0.59) MAOBIDO1AGXTALDH1A1TDP1
SCHEMBL6668911 0.80 IDO1 (0.58) MAOBIDO1AGXTALDH1A1TDP1
SCHEMBL27907502 0.79 MAPT (0.45) ALDH1A1TDP1MEN1LMNAKMT2A
SCHEMBL6666497 0.79 MMP1 (0.44) ALDH1A1TDP1RIPK1MEN1LMNA
SCHEMBL14162423 0.79 MAOB (0.54) MAOBIDO1AGXTALDH1A1TDP1
SCHEMBL3906109 0.78 CYP4F2 (0.53) MAOBALDH1A1TDP1GSK3BBACE1
SCHEMBL18100051 0.77 MAOB (0.49) MAOBIDO1AGXTALDH1A1TDP1
SCHEMBL14134236 0.77 RIPK1 (0.58) MAOBIDO1AGXTALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010081082-A2 PHOSPHORAMIDATE DERIVATIVES OF GUANOSINE NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS UNIVERSITY COLLEGE OF CARDIFF CONSULTANTS LIMITED (GB) 2010-07-15 WO disclosed