SCHEMBL9097764

SCHEMBL9097764

COc1cc(OC)c(OC)cc1C=C(C#N)c1ccc(F)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.70
▸ KMT2A Q03164 7/20 0.70
▸ MEN1 O00255 6/20 0.70
▸ LMNA P02545 3/20 0.70
▸ L3MBTL1 Q9Y468 2/20 0.70
▸ NPSR1 Q6W5P4 3/20 0.54
▸ ALDH1A1 P00352 3/20 0.54
▸ HTT P42858 2/20 0.54
▸ TDP1 Q9NUW8 2/20 0.54
▸ RECQL P46063 2/20 0.54
▸ THRB P10828 1/20 0.54
▸ PTPN7 P35236 1/20 0.52
▸ PTPN12 Q05209 1/20 0.52
▸ PTPN22 Q9Y2R2 1/20 0.52
▸ HPGD P15428 2/20 0.52
▸ POLB P06746 1/20 0.52
▸ NQO2 P16083 2/20 0.49
▸ NQO1 P15559 1/20 0.49
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ HSD17B10 Q99714 1/20 0.47

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
SCHEMBL9097760 1.00 MAPT (0.70) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL9096703 0.87 MAPT (0.55) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL9096699 0.87 MAPT (0.55) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL9097468 0.86 NPSR1 (0.54) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL9096678 0.86 MEN1 (0.54) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL9094705 0.86 MAPT (0.70) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL9094715 0.86 MAPT (0.70) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL9097464 0.86 NPSR1 (0.54) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL9096675 0.86 MEN1 (0.54) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL9095326 0.85 MAPT (0.53) MAPTKMT2AMEN1LMNAL3MBTL1

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
US-5574062-A COMPOUNDS HAVE 3-ARYL AND 7-HYDROXY OR -ACYLOXY; USE TO INHIBIT 12-LIPOXYGENASE MORINAGA MILK INDUSTRY CO., LTD. (JP) 1996-11-12 — — US disclosed
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