SCHEMBL6267989

SCHEMBL6267989

O=C(O)COc1cccc(OC(=O)c2cccs2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.54
KMT2A Q03164 8/20 0.50
ALOX15 P16050 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PLA2G1B P04054 2/20 0.49
ATG4B Q9Y4P1 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
MAPT P10636 1/20 0.49
HPGD P15428 3/20 0.48
POLB P06746 1/20 0.48
ALDH1A1 P00352 4/20 0.48
KDM4E B2RXH2 1/20 0.48
GLA P06280 1/20 0.48
GAA P10253 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NPC1 O15118 2/20 0.47
TSHR P16473 1/20 0.46
RAB9A P51151 1/20 0.46
CFD P00746 1/20 0.45
C1S P09871 1/20 0.45

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
SCHEMBL4810433 0.78 KMT2A (0.68) LMNAKMT2AALOX15SMN1; SMN2PLA2G1B
SCHEMBL413254 0.78 LMNA (0.81) LMNAKMT2AALOX15MAPTALDH1A1
SCHEMBL6265173 0.77 HPGD (0.54) LMNAKMT2AALOX15SMN1; SMN2PLA2G1B
Iodide SCHEMBL30758523 0.77 KMT2A (0.66) LMNAKMT2AALOX15SMN1; SMN2PLA2G1B
SCHEMBL15200218 0.77 KMT2A (0.61) LMNAKMT2AALOX15SMN1; SMN2PLA2G1B
SCHEMBL6624505 0.77 KMT2A (0.55) LMNAKMT2AALOX15SMN1; SMN2PLA2G1B
SCHEMBL6264975 0.76 KMT2A (0.50) LMNAKMT2AALOX15SMN1; SMN2PLA2G1B
SCHEMBL4679397 0.74 LMNA (0.70) LMNAALOX15
SCHEMBL14799462 0.74 NPC1 (0.71) LMNASMN1; SMN2TDP1MAPTHPGD
SCHEMBL12768208 0.73 PLA2G1B (0.64) LMNAKMT2AALOX15SMN1; SMN2PLA2G1B

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-2005081954-A2 INHIBITORS OF PROTEIN TYROSINE PHOSPHATASE 1B WYETH (US) 2005-09-09 WO disclosed