SCHEMBL30833243

SCHEMBL30833243

Nc1cccc(Nc2cccc(O)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.67
MEN1 O00255 3/20 0.67
TDP1 Q9NUW8 2/20 0.67
CYP3A4 P08684 2/20 0.67
MAPT P10636 2/20 0.67
GFER P55789 2/20 0.67
TSHR P16473 1/20 0.67
KDM4E B2RXH2 1/20 0.67
LMNA P02545 1/20 0.67
GAA P10253 1/20 0.67
ALDH1A1 P00352 4/20 0.64
CA12 O43570 1/20 0.64
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
CA7 P43166 1/20 0.64
CA9 Q16790 1/20 0.64
CA14 Q9ULX7 1/20 0.64
HDAC6 Q9UBN7 1/20 0.55
RAPGEF4 Q8WZA2 2/20 0.55
DDX3X O00571 1/20 0.52

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
SCHEMBL17508206 1.00 KMT2A (0.67) KMT2AMEN1TDP1CYP3A4MAPT
SCHEMBL30833244 1.00 KMT2A (0.67) KMT2AMEN1TDP1CYP3A4MAPT
SCHEMBL30026816 0.87 CYP3A4 (0.86) KMT2AMEN1CYP3A4MAPTGFER
SCHEMBL1389429 0.87 CYP3A4 (0.86) KMT2AMEN1CYP3A4MAPTGFER
SCHEMBL2127990 0.87 MAPT (0.86) KMT2AMEN1TDP1CYP3A4MAPT
SCHEMBL11475061 0.86 CYP3A4 (0.70) KMT2AMEN1TDP1CYP3A4MAPT
SCHEMBL13302358 0.84 CYP3A4 (0.82) KMT2AMEN1CYP3A4MAPTGFER
Hydrochloric Acid SCHEMBL31528395 0.84 MAPT (0.82) KMT2AMEN1TDP1CYP3A4MAPT
Hydrochloric Acid SCHEMBL21647359 0.84 MAPT (0.82) KMT2AMEN1TDP1CYP3A4MAPT
SCHEMBL564967 0.82 MAPT (0.60) KMT2AMEN1TDP1CYP3A4MAPT

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-117658779-A Method for recycling resorcinol and m-aminophenol 圣奥化学科技有限公司 2024-03-08 CN disclosed