SCHEMBL9535329

SCHEMBL9535329

CCCCSOC(=O)Oc1c(-c2c(Cl)cccc2Cl)noc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.47
PKM P14618 1/20 0.47
TSHR P16473 2/20 0.47
ALDH1A1 P00352 4/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
TDP1 Q9NUW8 3/20 0.43
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MEN1 O00255 1/20 0.43
PTGS2 P35354 2/20 0.42
POLB P06746 1/20 0.42
GHSR Q92847 2/20 0.42
SCN5A Q14524 1/20 0.42
SCN9A Q15858 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HPGD P15428 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL9532934 0.84 GLA (0.49) GLAPKMTSHRALDH1A1LMNA
SCHEMBL9533922 0.77 TSHR (0.59) GLAPKMTSHRALDH1A1LMNA
SCHEMBL5242545 0.77 ALDH1A1 (0.60) GLAPKMTSHRALDH1A1LMNA
SCHEMBL9537421 0.77 TSHR (0.53) GLAPKMTSHRALDH1A1LMNA
SCHEMBL9533158 0.76 SMN1; SMN2 (0.52) TSHRALDH1A1LMNAGAAMAPT
SCHEMBL9535614 0.75 TSHR (0.53) GLAPKMTSHRALDH1A1LMNA
SCHEMBL9534838 0.72 MAPT (0.56) TSHRALDH1A1LMNAMAPTTDP1
SCHEMBL9537042 0.70 SMN1; SMN2 (0.54) GLAALDH1A1LMNAGAAMAPT
SCHEMBL9533716 0.70 KMT2A (0.51) GLAPKMTSHRALDH1A1LMNA
SCHEMBL5242736 0.70 ALDH1A1 (0.58) GLAALDH1A1LMNAKMT2AMEN1

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