SCHEMBL1980293

SCHEMBL1980293

C=C(C)c1cc(Oc2ccc(NC(=O)[C@](CC)(NC(=O)O)C(C)(C)C)cn2)ccc1C#N

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.41
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
GFER P55789 1/20 0.38
PKM P14618 1/20 0.38
HRH3 Q9Y5N1 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RAB9A P51151 1/20 0.35
GAA P10253 1/20 0.34

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
SCHEMBL1978197 0.78 MAPT (0.43) ALDH1A1MAPTGFERPKMMEN1
SCHEMBL1979585 0.78 MAPT (0.43) ALDH1A1MAPTGFERPKMMEN1
SCHEMBL13721071 0.77 MAPT (0.37) ARALDH1A1MAPTGFERPKM
SCHEMBL19400305 0.77 MAPT (0.41) ARALDH1A1MAPTGFERPKM
SCHEMBL1979333 0.76 RAB9A (0.43) ALDH1A1MAPTGFERPKMMEN1
SCHEMBL13828839 0.76 CTSS (0.39) ARALDH1A1MAPTGFERPKM
SCHEMBL13721062 0.76 AR (0.38) ARALDH1A1MAPTPKMHRH3
SCHEMBL17350073 0.75 AR (0.37) ARALDH1A1MAPTGFERPKM
SCHEMBL1978918 0.73 PTGDR2 (0.40) ARALDH1A1MAPTMEN1KMT2A
SCHEMBL17354619 0.73 AR (0.40) ARHRH3RAB9AGAA

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
EP-2509961-A1 IMIDAZOLIDINEDIONE DERIVATIVES Autifony Therapeutics Limited (GB) 2012-10-17 EP disclosed
WO-2011069951-A1 IMIDAZOLIDINEDIONE DERIVATIVES GLAXO GROUP LIMITED (GB) 2011-06-16 WO disclosed