SCHEMBL3710974

SCHEMBL3710974

CCOC(=O)CN(C(=O)c1cccc(OC)c1)c1cc(Br)c(Oc2ccc(OC)c(C(C)C)c2)c(Br)c1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 9/20 0.42
THRA P10827 7/20 0.42
NR3C1 P04150 1/20 0.39
RORC P51449 2/20 0.38
MCHR1 Q99705 1/20 0.38
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 2/20 0.35
GLA P06280 1/20 0.35
TSHR P16473 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL3712010 0.93 NR3C1 (0.46) THRBTHRANR3C1RORCHTT
SCHEMBL3703153 0.92 THRB (0.45) THRBTHRANR3C1RORC
SCHEMBL3709210 0.92 THRB (0.41) THRBTHRANR3C1RORCMAPT
SCHEMBL3707754 0.91 THRB (0.44) THRBTHRARORCALDH1A1
SCHEMBL3705224 0.86 THRB (0.43) THRBTHRANR3C1RORCKDM4E
SCHEMBL3706682 0.86 THRB (0.39) THRBTHRARORCMAPTLMNA
SCHEMBL3710607 0.86 THRB (0.42) THRBTHRANR3C1RORCLMNA
SCHEMBL3713108 0.85 THRB (0.41) THRBTHRARORCMCHR1
SCHEMBL3708836 0.85 THRB (0.50) THRBTHRANR3C1RORC
SCHEMBL3714503 0.84 LMNA (0.47) THRBTHRARORCKDM4EMAPT

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-2010086878-A2 THYROID RECEPTOR MODULATORS CADILA HEALTHCARE LIMITED (IN) 2010-08-05 WO disclosed