SCHEMBL1754635

SCHEMBL1754635

O=C(c1ccc(F)c(F)c1O)N1N=C(c2ccc(Cl)cc2)SC1c1ccccc1OC(F)F

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 20/20 0.64
NR1H3 Q13133 14/20 0.64

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
SCHEMBL1753982 0.89 NR1H2 (0.71) NR1H2NR1H3
SCHEMBL1754040 0.87 NR1H2 (0.62) NR1H2NR1H3
SCHEMBL1754303 0.86 NR1H2 (0.64) NR1H2NR1H3
SCHEMBL1754234 0.86 NR1H2 (0.64) NR1H2NR1H3
SCHEMBL1753945 0.85 NR1H2 (0.61) NR1H2NR1H3
SCHEMBL1754414 0.84 NR1H2 (0.89) NR1H2NR1H3
SCHEMBL1754043 0.84 NR1H2 (0.68) NR1H2NR1H3
SCHEMBL1754391 0.83 NR1H2 (0.60) NR1H2NR1H3
SCHEMBL1754477 0.82 NR1H2 (0.73) NR1H2NR1H3
SCHEMBL1754214 0.81 NR1H2 (0.67) NR1H2NR1H3

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
US-8158662-B2 Compounds and compositions as LXR modulators HAMILTON (BM) 2012-04-17 US disclosed
US-8158662-B2 Compounds and compositions as LXR modulators HAMILTON (BM) 2012-04-17 US disclosed