SCHEMBL1965751

SCHEMBL1965751

O=C(O)COc1ccc(C(=O)Cl)cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.61
ALDH1A1 P00352 3/20 0.56
SMN1; SMN2 Q16637 1/20 0.55
FFAR1 O14842 1/20 0.55
PTPN7 P35236 2/20 0.53
MEN1 O00255 1/20 0.53
MAPT P10636 1/20 0.53
KMT2A Q03164 1/20 0.53
PTPN12 Q05209 1/20 0.53
TSHR P16473 1/20 0.50
NR4A1 P22736 1/20 0.50
APEX1 P27695 1/20 0.50
MCL1 Q07820 1/20 0.50
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
CYP19A1 P11511 1/20 0.48
ESR1 P03372 1/20 0.48

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
SCHEMBL4360696 0.86 PLA2G4B (0.44) ALOX15SMN1; SMN2MAPT
SCHEMBL339492 0.85 ALOX15 (0.81) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7
SCHEMBL29051537 0.83 ALOX15 (0.65) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7
SCHEMBL16035699 0.83 ALOX15 (0.65) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7
SCHEMBL341847 0.83 ALOX15 (0.65) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7
SCHEMBL5827387 0.83 ALOX15 (0.65) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7
SCHEMBL27341868 0.82 MAPT (0.42) ALOX15ALDH1A1SMN1; SMN2MAPTKMT2A
SCHEMBL10954272 0.81 MAPT (0.59) ALDH1A1MAPTTSHR
SCHEMBL8314675 0.81 ALOX15 (0.57) ALOX15ALDH1A1SMN1; SMN2FFAR1PTPN7
SCHEMBL459533 0.80 L3MBTL1 (0.66) ALOX15ALDH1A1SMN1; SMN2FFAR1MAPT

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-2509424-A1 NOVEL OXADIAZOLE COMPOUNDS Abbott Laboratories (US) 2012-10-17 EP disclosed
WO-2011071570-A1 NOVEL OXADIAZOLE COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-16 WO disclosed