SCHEMBL3707589

SCHEMBL3707589

CCOC(=O)CN(C(=O)c1ccccc1)c1cc(C)c(Oc2ccc(OC)c(C(C)CC)c2)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.38
THRA P10827 3/20 0.38
RORC P51449 1/20 0.37
CASP1 P29466 1/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
F2 P00734 1/20 0.36
F10 P00742 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
TSHR P16473 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
SCHEMBL3704314 0.93 THRB (0.44) THRBTHRARORCUSP2LMNA
SCHEMBL3711993 0.91 THRB (0.45) THRBTHRARORCUSP2LMNA
SCHEMBL3706682 0.91 THRB (0.39) THRBTHRARORCUSP2LMNA
SCHEMBL3226718 0.88 THRB (0.37) THRBTHRARORC
SCHEMBL3227804 0.85 THRB (0.39) THRBTHRARORC
SCHEMBL3219376 0.85 ALDH1A1 (0.38) THRBTHRARORCUSP2LMNA
SCHEMBL3713161 0.84 THRB (0.43) THRBTHRARORCLMNA
SCHEMBL3706521 0.84 RORC (0.53) THRBTHRARORC
SCHEMBL3703153 0.84 THRB (0.45) THRBTHRARORC
SCHEMBL3704007 0.82 THRB (0.43) THRBTHRARORCUSP2LMNA

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