SCHEMBL8799519

SCHEMBL8799519

O=C(O)C(=O)Nc1cc(Cl)c(Oc2ccc(O)c(Cc3ccc(Cl)cc3)c2)c(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRA P10827 5/20 0.45
THRB P10828 5/20 0.45
EPHX1 P07099 1/20 0.42
EPHX2 P34913 1/20 0.42

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
SCHEMBL8800915 0.92 THRA (0.54) THRATHRB
SCHEMBL8799243 0.89 THRA (0.59) THRATHRB
SCHEMBL18932858 0.84 THRB (0.45) THRATHRB
SCHEMBL18932861 0.83 THRA (0.54) THRATHRBEPHX1EPHX2
SCHEMBL18932873 0.82 THRA (0.53) THRATHRBEPHX1EPHX2
SCHEMBL18946167 0.82 THRA (0.43) THRATHRBEPHX1EPHX2
SCHEMBL6662880 0.82 THRA (0.48) THRATHRB
SCHEMBL8892026 0.81 THRA (0.46) THRATHRBEPHX1EPHX2
SCHEMBL18946159 0.81 THRA (0.44) THRATHRBEPHX1EPHX2
SCHEMBL8800887 0.79 THRA (0.62) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0580550-B1 Oxamic acid derivatives as hypocholesteremic agents CIBA GEIGY AG (CH) 1997-10-22 EP disclosed
US-5654468-A ANTILIPID, ANTICHOLESTEROL AGENTS CIBA-GEIGY CORPORATION (US) 1997-08-05 US disclosed
US-5569674-A ANTICHOLESTEROL AGENTS CIBA-GEIGY CORPORATION (US) 1996-10-29 US disclosed
US-5401772-A Anticholesterol agents with aromatic amines CIBA-GEIGY CORPORATION (US) 1995-03-28 US disclosed
EP-0580550-A1 Oxamic acid derivatives as hypocholesteremic agents CIBA-GEIGY AG (CH) 1994-01-26 EP disclosed