SCHEMBL7092430

SCHEMBL7092430

C[C@H](N)c1cc(Cl)c(Oc2ccc3[nH]cc(S(=O)(=O)c4ccccc4)c3c2)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
THRA P10827 3/20 0.43
THRB P10828 3/20 0.43
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
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
LMNA P02545 2/20 0.40
TP53 P04637 3/20 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
SCHEMBL7087709 1.00 MAPT (0.47) MAPTTHRATHRBSMN1; SMN2HTT
SCHEMBL7091728 0.89 MAPT (0.51) MAPTTHRATHRBSMN1; SMN2HTT
SCHEMBL6512802 0.88 MAPT (0.43) MAPTTHRATHRBSMN1; SMN2HTT
SCHEMBL6514011 0.88 MAPT (0.43) MAPTTHRATHRBSMN1; SMN2HTT
SCHEMBL6512794 0.88 MAPT (0.43) MAPTTHRATHRBSMN1; SMN2HTT
SCHEMBL7089217 0.88 MAPT (0.47) MAPTTHRATHRBSMN1; SMN2HTT
SCHEMBL6520646 0.82 MAPT (0.56) MAPTTHRATHRBSMN1; SMN2HTT
SCHEMBL6515767 0.82 MAPT (0.53) MAPTTHRATHRBSMN1; SMN2HTT
SCHEMBL6522342 0.82 MAPT (0.53) MAPTTHRATHRBSMN1; SMN2HTT
SCHEMBL6520650 0.82 MAPT (0.56) MAPTTHRATHRBSMN1; SMN2HTT

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