SCHEMBL28026657

SCHEMBL28026657

O=P(O)(O)OC(Cn1cncn1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
ALDH1A1 P00352 1/20 0.46
IDH1 O75874 1/20 0.42
CYP19A1 P11511 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL11210976 0.81 CYP19A1 (0.50) KMT2AMEN1ALDH1A1IDH1CYP19A1
SCHEMBL7789025 0.78 KMT2A (0.48) KMT2AMEN1ALDH1A1IDH1LMNA
SCHEMBL10959984 0.74 CYP19A1 (0.56) KMT2AMEN1ALDH1A1IDH1CYP19A1
SCHEMBL7783933 0.73 TSHR (0.58) KMT2AMEN1ALDH1A1CYP19A1LMNA
SCHEMBL5544140 0.73 TSHR (0.58) KMT2AMEN1ALDH1A1CYP19A1LMNA
SCHEMBL28054792 0.73 KMT2A (0.53) KMT2AMEN1ALDH1A1IDH1CYP19A1
SCHEMBL12462114 0.71 CYP19A1 (0.53) KMT2AMEN1ALDH1A1CYP19A1LMNA
SCHEMBL28054794 0.71 CYP19A1 (0.49) KMT2AMEN1ALDH1A1IDH1CYP19A1
SCHEMBL27575719 0.70 KMT2A (0.48) KMT2AMEN1ALDH1A1IDH1CYP19A1
SCHEMBL11127036 0.70 CYP19A1 (0.56) KMT2AMEN1ALDH1A1CYP19A1LMNA

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
CN-104926870-A Fosfluconazole refining method HEFEI JIUNUO MEDICAL TECHNOLOGY CO LTD 2015-09-23 CN disclosed