SCHEMBL7089088

SCHEMBL7089088

O=S(=O)(c1ccc(C(F)(F)F)cc1)c1c[nH]c2ccc(Oc3c(Cl)c[c]cc3Cl)cc12

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
SMN1; SMN2 Q16637 4/20 0.42
HTT P42858 3/20 0.42
POLB P06746 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
LMNA P02545 2/20 0.42
KDM4E B2RXH2 2/20 0.40
DUSP3 P51452 1/20 0.38
PTPN5 P54829 1/20 0.38
PTPN11 Q06124 1/20 0.38
TP53 P04637 2/20 0.37
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
RXFP1 Q9HBX9 2/20 0.36
THRB P10828 4/20 0.35
THRA P10827 3/20 0.35
TRPV1 Q8NER1 1/20 0.34

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
SCHEMBL7090124 0.89 MAPT (0.48) MAPTSMN1; SMN2HTTPOLBTDP1
SCHEMBL7088467 0.88 MAPT (0.47) MAPTSMN1; SMN2HTTPOLBTDP1
SCHEMBL7093571 0.88 MAPT (0.53) MAPTSMN1; SMN2HTTPOLBTDP1
SCHEMBL7088836 0.88 MAPT (0.47) MAPTSMN1; SMN2HTTPOLBTDP1
SCHEMBL7089964 0.87 MAPT (0.61) MAPTSMN1; SMN2HTTPOLBTDP1
SCHEMBL7089688 0.85 MAPT (0.43) MAPTSMN1; SMN2HTTPOLBTDP1
SCHEMBL6860598 0.84 MAPT (0.44) MAPTSMN1; SMN2HTTPOLBTDP1
SCHEMBL6513235 0.83 THRB (0.55) MAPTSMN1; SMN2HTTPOLBTDP1
SCHEMBL6859231 0.82 THRB (0.43) MAPTSMN1; SMN2HTTPOLBTDP1
SCHEMBL6514162 0.82 MAPT (0.42) MAPTSMN1; SMN2HTTPOLBTDP1

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-1347959-A1 INDOLE DERIVATIVES AS LIGANDS OF THYROID RECEPTORS Bayer Aktiengesellschaft (DE) 2003-10-01 EP disclosed
WO-2002051805-A1 INDOLE DERIVATIVES AS LIGANDS OF THYROID RECEPTORS BAYER AKTIENGESELLSCHAFT (DE) 2002-07-04 WO disclosed