SCHEMBL9537105

SCHEMBL9537105

Cc1onc(-c2ccc(Cl)cc2)c1OC(=O)Nc1cccc(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.56
ALDH1A1 P00352 3/20 0.56
PLA2G1B P04054 1/20 0.56
ATG4B Q9Y4P1 1/20 0.56
KMT2A Q03164 7/20 0.47
MEN1 O00255 6/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
ATM Q13315 1/20 0.47
HPGD P15428 1/20 0.46
ALOX15 P16050 1/20 0.46
PDGFRB P09619 2/20 0.46
MET P08581 1/20 0.46
CDK8 P49336 1/20 0.46
ROCK1 Q13464 1/20 0.46
NTRK3 Q16288 1/20 0.46
NTRK2 Q16620 1/20 0.46
AURKB Q96GD4 1/20 0.46
CLK4 Q9HAZ1 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46

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
SCHEMBL9536170 0.85 MAPT (0.52) MAPTALDH1A1PLA2G1BATG4BKMT2A
SCHEMBL9537454 0.85 GHSR (0.50) ALDH1A1KMT2AMEN1NPC1RAB9A
SCHEMBL9534238 0.81 POLB (0.45) MAPTKMT2AMEN1SMN1; SMN2TP53
SCHEMBL9533383 0.77 GPBAR1 (0.51) MAPTKMT2AMEN1NPC1MAPK1
SCHEMBL9535755 0.75 ALDH1A1 (0.52) MAPTALDH1A1SMN1; SMN2TP53MAPK1
SCHEMBL9533937 0.74 ALDH1A1 (0.50) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL9533918 0.71 MAPT (0.64) MAPTALDH1A1KMT2AMEN1NPC1
SCHEMBL9535442 0.71 GPBAR1 (0.51) MAPTALDH1A1KMT2AMEN1NPC1
SCHEMBL9533388 0.70 TSHR (0.51) MAPTALDH1A1KMT2AMEN1NPC1
SCHEMBL9533884 0.70 KMT2A (0.59) MAPTALDH1A1KMT2AMEN1NPC1

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
EP-0573883-A1 Utilization of 3 substituted aryl-5-alkyl-isoxazole-4-carboxylic acid derivatives against endoparasites new 3-substituted aryl-5-alkyl-isoxazole-4-carboxylic acid derivatives and process for their preparation BAYER AG (DE) 1993-12-15 EP disclosed