SCHEMBL7794963

SCHEMBL7794963

CCOC(=O)C(=O)Nc1cc(Cl)c(Oc2ccc(O)c(CN(CC)c3ccccc3)c2)c(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
THRA P10827 5/20 0.54
THRB P10828 5/20 0.54
ALDH1A1 P00352 1/20 0.44
EPHX1 P07099 3/20 0.42
EPHX2 P34913 3/20 0.42
CYP19A1 P11511 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
SCHEMBL6658489 0.82 THRA (0.60) THRATHRBEPHX1EPHX2
SCHEMBL6658672 0.81 THRA (0.57) THRATHRB
SCHEMBL6666173 0.81 THRA (0.53) THRATHRB
SCHEMBL6661412 0.81 THRA (0.53) THRATHRB
SCHEMBL7795929 0.81 THRA (0.53) THRATHRB
SCHEMBL6664791 0.80 THRA (0.54) THRATHRBALDH1A1
SCHEMBL6658230 0.80 THRA (0.62) THRATHRBEPHX1EPHX2
SCHEMBL6657705 0.79 THRB (0.52) THRATHRBALDH1A1
SCHEMBL6657368 0.79 THRA (0.56) THRATHRBALDH1A1EPHX1EPHX2
SCHEMBL6658717 0.78 THRA (0.54) THRATHRB

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-1157001-A1 OXAMIC ACIDS AND DERIVATIVES AS THYROID RECEPTOR LIGANDS Pfizer Products Inc. (US) 2001-11-28 EP disclosed
WO-2000051971-A1 OXAMIC ACIDS AND DERIVATIVES AS THYROID RECEPTOR LIGANDS PFIZER PRODUCTS INC. (US) 2000-09-08 WO disclosed