SCHEMBL10489244

SCHEMBL10489244

CC(C)(C)C(O)C(C(O)c1ccc(Cl)cc1)n1cncn1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
POLB P06746 1/20 0.60
HSP90AA1 P07900 1/20 0.60
CYP19A1 P11511 14/20 0.54
TDP1 Q9NUW8 2/20 0.52
CYP3A4 P08684 1/20 0.46
CYP11B1 P15538 1/20 0.41

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
SCHEMBL11153097 0.88 CYP19A1 (0.55) MEN1KMT2APOLBHSP90AA1CYP19A1
SCHEMBL11002874 0.85 MEN1 (0.55) MEN1KMT2APOLBHSP90AA1CYP19A1
SCHEMBL7942524 0.83 MEN1 (0.62) MEN1KMT2APOLBHSP90AA1CYP19A1
SCHEMBL11233496 0.80 CYP19A1 (0.52) MEN1KMT2APOLBHSP90AA1CYP19A1
SCHEMBL9367742 0.79 CYP19A1 (0.61) MEN1KMT2APOLBHSP90AA1CYP19A1
SCHEMBL10996249 0.78 KMT2A (0.48) MEN1KMT2APOLBHSP90AA1CYP19A1
SCHEMBL11032759 0.77 CYP19A1 (0.52) MEN1KMT2APOLBHSP90AA1CYP19A1
SCHEMBL11156120 0.77 CYP19A1 (0.46) MEN1KMT2APOLBHSP90AA1CYP19A1
SCHEMBL9364205 0.76 CYP3A4 (0.59) MEN1KMT2APOLBHSP90AA1CYP19A1
SCHEMBL19304858 0.76 KMT2A (0.51) MEN1KMT2APOLBHSP90AA1CYP19A1

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
JP-1022860-A None JP disclosed