SCHEMBL9513680

SCHEMBL9513680

COC(=O)COc1ccc(CCNC(=O)OCc2ccccc2)cc1F

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
LMNA P02545 2/20 0.46
KEAP1 Q14145 2/20 0.45
NFE2L2 Q16236 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HTT P42858 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 1/20 0.44
MAPK1 P28482 1/20 0.44
MTNR1A P48039 2/20 0.43
MTNR1B P49286 2/20 0.43
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL4833609 0.83 L3MBTL1 (0.55) L3MBTL1MAPTSMN1; SMN2LMNAKEAP1
SCHEMBL6631094 0.81 LMNA (0.51) L3MBTL1MAPTSMN1; SMN2LMNAKEAP1
SCHEMBL9510810 0.81 CA1 (0.46) MAPTSMN1; SMN2LMNAMEN1KMT2A
SCHEMBL3627156 0.79 SMN1; SMN2 (0.55) L3MBTL1MAPTSMN1; SMN2LMNAKEAP1
SCHEMBL23291265 0.79 LTA4H (0.51) L3MBTL1MAPTSMN1; SMN2LMNAKEAP1
SCHEMBL23291243 0.79 LTA4H (0.61) HTT
SCHEMBL9513676 0.78 CA1 (0.49) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL24541715 0.77 LMNA (0.55) L3MBTL1MAPTSMN1; SMN2LMNAKEAP1
SCHEMBL30559742 0.77 LMNA (0.55) L3MBTL1MAPTSMN1; SMN2LMNAKEAP1
SCHEMBL10792509 0.76 SMN1; SMN2 (0.53) L3MBTL1MAPTSMN1; SMN2LMNAKEAP1

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-0325245-B1 Phenoxyacetic acid derivatives, preparation thereof, pharmaceutical compositions comprising them and use TANABE SEIYAKU CO (JP) 1993-10-20 EP disclosed
US-4948810-A PLATELET AGGREGATION INHIBITORS TANABE SEIYAKU CO., LTD. (JP) 1990-08-14 US disclosed
EP-0325245-A1 Phenoxyacetic acid derivatives, preparation thereof, pharmaceutical compositions comprising them and use TANABE SEIYAKU CO., LTD. (JP) 1989-07-26 EP disclosed