SCHEMBL8745463

SCHEMBL8745463

CNC(Cc1cc(Br)c(Oc2ccc(O)cc2)c(Br)c1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
THRA P10827 14/20 0.51
THRB P10828 14/20 0.51
PCNA P12004 4/20 0.48
PPARG P37231 1/20 0.45

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
SCHEMBL21598075 0.83 FOLH1 (0.52) PPARG
SCHEMBL21598076 0.83 FOLH1 (0.52) PPARG
SCHEMBL8745418 0.81 PCNA (0.72) THRATHRBPCNAPPARG
SCHEMBL7630334 0.81 PCNA (0.72) THRATHRBPCNAPPARG
SCHEMBL3961476 0.80 HPGD (0.41) THRATHRBPPARG
SCHEMBL8745433 0.78 KMT2A (0.48) THRATHRBPPARG
SCHEMBL8745406 0.78 KMT2A (0.48) THRATHRBPPARG
SCHEMBL8745435 0.77 THRA (0.48) THRATHRBPCNAPPARG
SCHEMBL161943 0.76 FOLH1 (0.60)
SCHEMBL160418 0.76 FOLH1 (0.60)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0612308-B1 METHOD FOR PREPARING RADIO-IODINATED THYRONINE DERIVATIVES; NOVEL INTERMEDIATES HENNING BERLIN GMBH (DE) 1997-02-05 EP disclosed
EP-0612308-A1 METHOD FOR PREPARING RADIO-IODINATED THYRONINE DERIVATIVES; NOVEL INTERMEDIATES. HENNING BERLIN GMBH (DE) 1994-08-31 EP disclosed
WO-1993009076-A1 METHOD FOR PREPARING RADIO-IODINATED THYRONINE DERIVATIVES; NOVEL INTERMEDIATES HENNING BERLIN GMBH CHEMIE- UND PHARMAWERK (DE) 1993-05-13 WO disclosed