SCHEMBL7093569

SCHEMBL7093569

Cc1c[c]c(N)c(C)c1Oc1ccc2[nH]cc(S(=O)(=O)c3ccccc3)c2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
KDM4E B2RXH2 2/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
HTT P42858 3/20 0.39
LMNA P02545 2/20 0.39
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
RXFP1 Q9HBX9 2/20 0.39

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
SCHEMBL7090864 0.92 MAPT (0.60) MAPTTP53SMN1; SMN2KDM4EHTT
SCHEMBL7085558 0.90 MAPT (0.47) MAPTTP53SMN1; SMN2KDM4EHDAC3
SCHEMBL7090893 0.88 MAPT (0.48) MAPTTP53SMN1; SMN2KDM4EHTT
SCHEMBL7092885 0.82 MAPT (0.44) MAPTTP53SMN1; SMN2KDM4EHDAC3
SCHEMBL7090098 0.79 MAPT (0.41) MAPTTP53SMN1; SMN2KDM4EHDAC3
SCHEMBL7090569 0.79 MAPT (0.47) MAPTTP53SMN1; SMN2KDM4EHDAC3
SCHEMBL7091728 0.78 MAPT (0.51) MAPTTP53SMN1; SMN2KDM4EHDAC3
SCHEMBL7092628 0.77 MAPT (0.67) MAPTTP53SMN1; SMN2KDM4EHTT
SCHEMBL7087686 0.77 MAPT (0.58) MAPTTP53SMN1; SMN2KDM4EHTT
SCHEMBL6514502 0.77 MAPT (0.49) MAPTTP53SMN1; SMN2KDM4EHDAC3

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