SCHEMBL9677455

SCHEMBL9677455

COc1ccc(N2C(=O)OC(CO)C2=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.46
POLB P06746 2/20 0.45
ELANE P08246 1/20 0.44
ALDH1A1 P00352 5/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MAPT P10636 3/20 0.43
APOBEC3G Q9HC16 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TSHR P16473 1/20 0.41
NR1H3 Q13133 1/20 0.40
ESR1 P03372 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
GRM2 Q14416 1/20 0.40

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
SCHEMBL1223003 0.70 GRM2 (0.67) GRM2
SCHEMBL8941864 0.70 HSD11B1 (0.43) MGLLPOLBELANEMEN1KMT2A
SCHEMBL1223001 0.70 GRM2 (0.67) GRM2
SCHEMBL10919797 0.66 MAOA (0.51) ALDH1A1MAPTTSHRGAA
SCHEMBL12616362 0.66 HSD11B1 (0.51) MGLLELANEALDH1A1L3MBTL1
SCHEMBL7294352 0.65 GRM2 (0.71) GRM2
SCHEMBL16786672 0.65 MEN1 (0.56) MGLLPOLBELANEALDH1A1MEN1
SCHEMBL22571115 0.65 ALDH1A1 (0.59) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL8636371 0.65 ALDH1A1 (0.59) POLBALDH1A1MEN1KMT2AMAPT
SCHEMBL13186564 0.65 ALDH1A1 (0.69) MGLLPOLBELANEALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300272-B1 OXAZOLIDINONES MERCK PATENT GmbH (DE) 1992-09-16 EP disclosed
EP-0300272-A1 Oxazolidinones MERCK PATENT GmbH (DE) 1989-01-25 EP disclosed