SCHEMBL5740796

SCHEMBL5740796

O=C1C2CCCN2C(=O)N1c1ccc(C(F)(F)F)cc1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.67
KMT2A Q03164 6/20 0.49
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
GLA P06280 1/20 0.40
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HSP90AA1 P07900 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL5739794 1.00 AR (0.67) ARKMT2AMEN1POLBGLA
SCHEMBL11174171 0.84 AR (0.64) ARKMT2AMEN1POLBALDH1A1
SCHEMBL13879545 0.81 AR (0.60) ARKMT2AMEN1POLBALDH1A1
SCHEMBL12543889 0.81 AR (0.56) ARKMT2AMEN1POLBRAB9A
SCHEMBL5740339 0.80 KMT2A (0.72) ARKMT2AMEN1POLBRAB9A
SCHEMBL13879554 0.77 TSHR (0.61) ARKMT2APOLBALDH1A1
SCHEMBL11041126 0.77 AR (0.55) ARKMT2AMEN1POLBALDH1A1
SCHEMBL15919496 0.77 AR (0.52) ARKMT2AMEN1POLBRAB9A
SCHEMBL12542557 0.76 AR (0.56) ARKMT2AMEN1POLBALDH1A1
SCHEMBL5740800 0.76 KMT2A (0.66) ARKMT2AMEN1RAB9AALDH1A1

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
EP-1244670-B1 HYDANTOIN DERIVATIVE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USING SAME MGI GP INC (US) 2006-03-08 EP claimed