SCHEMBL7093571

SCHEMBL7093571

Cc1c[c]cc(C)c1Oc1ccc2[nH]cc(S(=O)(=O)c3ccc(C(F)(F)F)cc3)c2c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.53
SMN1; SMN2 Q16637 4/20 0.44
HTT P42858 3/20 0.44
LMNA P02545 2/20 0.44
TP53 P04637 2/20 0.44
KDM4E B2RXH2 2/20 0.43
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
RXFP1 Q9HBX9 2/20 0.42
POLB P06746 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
DUSP3 P51452 1/20 0.38
PTPN5 P54829 1/20 0.38
PTPN11 Q06124 1/20 0.38
THRA P10827 3/20 0.36
THRB P10828 3/20 0.36
TRPV1 Q8NER1 1/20 0.36
PTGS2 P35354 1/20 0.36
BACE1 P56817 1/20 0.35

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
SCHEMBL7092489 0.89 MAPT (0.54) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL7090124 0.89 MAPT (0.48) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL7092628 0.89 MAPT (0.67) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL7092492 0.88 MAPT (0.53) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL7089088 0.88 MAPT (0.47) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL7088467 0.88 MAPT (0.47) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL7090097 0.88 MAPT (0.66) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL7090893 0.87 MAPT (0.48) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL7090569 0.85 MAPT (0.47) MAPTSMN1; SMN2HTTLMNATP53
SCHEMBL6860428 0.84 MAPT (0.48) MAPTSMN1; SMN2HTTLMNATP53

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