SCHEMBL7258655

SCHEMBL7258655

COC(=O)Nc1cc(Oc2ccc(OC)c(C(C)C)c2)c(Cl)c(Cl)n1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 12/20 0.46
▸ THRB P10828 6/20 0.46
▸ LPAR1 Q92633 3/20 0.38
▸ THRA P10827 1/20 0.38

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
SCHEMBL7258641 0.79 RORC (0.49) RORCTHRBTHRA
SCHEMBL8062067 0.71 RORC (0.51) RORCTHRBTHRA
SCHEMBL6691996 0.70 RORC (0.55) RORCTHRBTHRA
SCHEMBL22959176 0.68 RORC (0.70) RORCTHRBTHRA
SCHEMBL22959162 0.68 RORC (0.70) RORCTHRBTHRA
SCHEMBL6694690 0.68 RORC (0.56) RORCTHRBTHRA
SCHEMBL282476 0.68 RORC (0.66) RORCTHRBTHRA
SCHEMBL6367085 0.67 RORC (0.62) RORCTHRBLPAR1
SCHEMBL11206396 0.67 KDM4E (0.56) RORCTHRBLPAR1
SCHEMBL8799780 0.67 RORC (0.68) RORCTHRBTHRA

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-2003094845-A2 PYRIDINE-BASED THYROID RECEPTOR LIGANDS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-11-20 — — WO disclosed
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