SCHEMBL5327154

SCHEMBL5327154

CCN(CC)S(=O)(=O)c1cc(Oc2c(Cl)cc(N3CC(=O)NC3=O)cc2Cl)ccc1OC

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 4/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 3/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.35
LMNA P02545 3/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
USP2 O75604 1/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TP53 P04637 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
SCHEMBL5323684 0.90 TSHR (0.40) TSHRKDM4EALDH1A1MAPTKMT2A
SCHEMBL5328330 0.88 THRB (0.43) TSHRKMT2ASMN1; SMN2MEN1LMNA
SCHEMBL5331463 0.84 TSHR (0.38) TSHRKDM4EALDH1A1KMT2APOLB
SCHEMBL5326299 0.84 L3MBTL1 (0.49) KDM4EALDH1A1KMT2APOLBMEN1
SCHEMBL5328482 0.83 ALDH1A1 (0.52) TSHRKDM4EALDH1A1KMT2APOLB
SCHEMBL5324510 0.82 THRB (0.38) ALDH1A1MAPTSMN1; SMN2LMNARAB9A
SCHEMBL5329550 0.80 THRB (0.39) KDM4EALDH1A1MAPTKMT2APOLB
SCHEMBL5326354 0.79 THRB (0.51) ALDH1A1KMT2ASMN1; SMN2MEN1MAPK1
SCHEMBL5326859 0.78 THRB (0.46)
SCHEMBL5323874 0.77 RORC (0.55)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007132475-A1 SELECTIVE TR-BETA 1 AGONIST CADILA HEALTHCARE LIMITED (IN) 2007-11-22 WO claimed