SCHEMBL7091960

SCHEMBL7091960

Cc1cc(C(F)(F)F)c(Oc2ccc3[nH]cc(S(=O)(=O)c4ccccc4)c3c2)c(C(F)(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.55
THRA P10827 7/20 0.48
THRB P10828 7/20 0.48
SMN1; SMN2 Q16637 4/20 0.44
KDM4E B2RXH2 2/20 0.44
HTT P42858 3/20 0.43
LMNA P02545 2/20 0.43
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 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
SCHEMBL6512608 0.85 THRA (0.65) MAPTTHRATHRBSMN1; SMN2KDM4E
SCHEMBL7090569 0.85 MAPT (0.47) MAPTTHRATHRBSMN1; SMN2KDM4E
SCHEMBL6515723 0.85 THRA (0.50) MAPTTHRATHRBSMN1; SMN2KDM4E
SCHEMBL6512566 0.84 THRA (0.52) MAPTTHRATHRBSMN1; SMN2KDM4E
SCHEMBL6512134 0.84 THRA (0.47) MAPTTHRATHRBSMN1; SMN2KDM4E
SCHEMBL6514042 0.84 THRA (0.47) MAPTTHRATHRBSMN1; SMN2KDM4E
SCHEMBL6512575 0.83 THRA (0.60) MAPTTHRATHRBSMN1; SMN2KDM4E
SCHEMBL6511333 0.83 THRA (0.64) MAPTTHRATHRBSMN1; SMN2KDM4E
SCHEMBL6517156 0.83 THRA (0.48) MAPTTHRATHRBSMN1; SMN2KDM4E
SCHEMBL7087285 0.82 MAPT (0.59) MAPTTHRATHRBSMN1; SMN2KDM4E

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