SCHEMBL1754716

SCHEMBL1754716

CCC(C)(C)NC(=O)COc1cccc(C2SC(c3ccc(F)cc3)=NN2C(=O)c2ccccc2O)c1OC

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 19/20 0.56
NR1H3 Q13133 14/20 0.56
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL1754600 0.94 NR1H2 (0.56) NR1H2NR1H3MEN1KMT2A
SCHEMBL1754462 0.93 NR1H2 (0.59) NR1H2NR1H3MEN1KMT2A
SCHEMBL1754712 0.91 NR1H2 (0.55) NR1H2NR1H3MEN1KMT2A
SCHEMBL1754596 0.91 NR1H2 (0.57) NR1H2NR1H3MEN1KMT2A
SCHEMBL1754719 0.90 NR1H2 (0.55) NR1H2NR1H3MEN1KMT2A
SCHEMBL1754351 0.88 NR1H2 (0.58) NR1H2NR1H3MEN1KMT2A
SCHEMBL1754603 0.88 NR1H2 (0.56) NR1H2NR1H3MEN1KMT2A
SCHEMBL1754279 0.87 NR1H2 (0.59) NR1H2NR1H3MEN1KMT2A
SCHEMBL2109260 0.87 NR1H2 (0.64) NR1H2NR1H3MEN1KMT2A
SCHEMBL1754707 0.87 NR1H2 (0.56) NR1H2NR1H3MEN1KMT2A

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