SCHEMBL8034356

SCHEMBL8034356

O=C(O)C[C@@H]1OC(c2ccccc2)=N[C@H]1Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 2/20 0.40
USP1 O94782 1/20 0.37
WDR48 Q8TAF3 1/20 0.37
POLB P06746 2/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.36
KDM4E B2RXH2 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 1/20 0.36
CTRB1 P17538 1/20 0.35
CES2 O00748 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SCD O00767 1/20 0.34
SCD5 Q86SK9 1/20 0.34
AKR1B1 P15121 1/20 0.34
ABCC4 O15439 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL8034360 1.00 MMP9 (0.40) MMP9USP1WDR48POLBPTGDR2
SCHEMBL8034368 0.85 TSHR (0.40) TSHR
SCHEMBL8021210 0.81 MMP9 (0.39) MMP9USP1WDR48KDM4ENPC1
SCHEMBL8021205 0.81 MMP9 (0.39) MMP9USP1WDR48KDM4ENPC1
SCHEMBL8032366 0.81 MMP9 (0.43) MMP9USP1WDR48POLBNPC1
SCHEMBL8032370 0.81 MMP9 (0.43) MMP9USP1WDR48POLBNPC1
SCHEMBL8021153 0.79 MMP9 (0.44) MMP9USP1WDR48POLBNPC1
SCHEMBL8021154 0.79 MMP9 (0.44) MMP9USP1WDR48POLBNPC1
SCHEMBL8021184 0.78 USP1 (0.44) MMP9USP1WDR48POLBKDM4E
SCHEMBL8021186 0.78 USP1 (0.44) MMP9USP1WDR48POLBKDM4E

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
US-6127546-A Process for the preparation of oxazoline compound DONG KOOK PHARMACEUTICAL CO., LTD. (KR) 2000-10-03 US disclosed