SCHEMBL5366172

SCHEMBL5366172

O=C(NCc1ccc(OC(F)F)cc1)c1sc(Nc2ccc(F)cc2)nc1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 3/20 0.53
DHODH Q02127 6/20 0.50
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
MAPT P10636 3/20 0.49
ALDH1A1 P00352 3/20 0.49
KDM4E B2RXH2 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
ALOX5 P09917 1/20 0.48
PTGS2 P35354 1/20 0.48
LMNA P02545 3/20 0.48
ALOX12 P18054 2/20 0.48
NPSR1 Q6W5P4 1/20 0.48
HTT P42858 1/20 0.47
ADORA2B P29275 1/20 0.46
HPGD P15428 1/20 0.46
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46
NCOA1 Q15788 1/20 0.46
NCOA3 Q9Y6Q9 1/20 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
SCHEMBL5418954 0.90 LMNA (0.48) PTGDR2DHODHMEN1KMT2AMAPT
SCHEMBL5397042 0.89 KMT2A (0.58) PTGDR2DHODHMEN1KMT2AMAPT
SCHEMBL5415273 0.86 PPARA (0.49) PTGDR2MEN1KMT2AMAPTALDH1A1
SCHEMBL5398487 0.84 PPARA (0.49) DHODHMEN1KMT2AMAPTALDH1A1
SCHEMBL5364912 0.82 KMT2A (0.67) PTGDR2DHODHMEN1KMT2AMAPT
SCHEMBL5402842 0.81 DHODH (0.62) PTGDR2DHODHMEN1KMT2AMAPT
SCHEMBL5412970 0.79 PTGDR2 (0.62) PTGDR2MEN1KMT2AMAPTALDH1A1
SCHEMBL5402536 0.79 LMNA (0.55) PTGDR2DHODHMEN1KMT2AMAPT
SCHEMBL5369173 0.78 KMT2A (0.59) PTGDR2DHODHMEN1KMT2AMAPT
SCHEMBL5403867 0.78 LMNA (0.39) DHODHMEN1KMT2AMAPTALDH1A1

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-2007138110-A2 COMPOUNDS THAT INTERACT WITH ION CHANNELS, IN PARTICULAR WITH ION CHANNELS FROM THE KV FAMILY DEVGEN N.V. (BE) 2007-12-06 WO claimed