SCHEMBL10728362

SCHEMBL10728362

Nc1ccc(NC(=O)c2ccccc2Cl)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.67
MEN1 O00255 3/20 0.67
MMP14 P50281 1/20 0.67
CASP3 P42574 2/20 0.57
ADORA2A P29274 2/20 0.54
HPGD P15428 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C19 P33261 1/20 0.54
RAB9A P51151 2/20 0.52
CSNK1A1 P48729 2/20 0.50
CSNK1D P48730 2/20 0.50
CSNK1G1 Q9HCP0 2/20 0.50
FGR P09769 1/20 0.50
PIM1 P11309 1/20 0.50
MAOA P21397 1/20 0.50
DYRK1A Q13627 1/20 0.50
HIPK2 Q9H2X6 1/20 0.50
ALDH1A1 P00352 4/20 0.48
LMNA P02545 2/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL6421532 0.92 CASP3 (0.65) KMT2AMEN1MMP14CASP3HPGD
SCHEMBL10728647 0.89 MEN1 (0.63) KMT2AMEN1MMP14CASP3ADORA2A
SCHEMBL11140007 0.88 MEN1 (0.62) KMT2AMEN1MMP14CASP3ADORA2A
SCHEMBL10726128 0.86 CASP3 (0.66) KMT2AMEN1MMP14CASP3ADORA2A
SCHEMBL11142635 0.85 MEN1 (0.62) KMT2AMEN1MMP14CASP3ADORA2A
SCHEMBL11295940 0.83 CASP3 (0.53) KMT2AMEN1MMP14CASP3HPGD
SCHEMBL10750834 0.82 CASP3 (0.65) KMT2AMEN1MMP14CASP3ADORA2A
SCHEMBL11418929 0.82 CASP3 (0.76) CASP3HPGDCYP1A2CYP2C19RAB9A
SCHEMBL9846531 0.82 MEN1 (0.80) KMT2AMEN1MMP14CASP3ADORA2A
SCHEMBL6141826 0.81 MEN1 (1.00) KMT2AMEN1MMP14CASP3ADORA2A

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4709019-A COLORFAST PIGMENTS BAYER AKTIENGESELLSCHAFT (DE) 1987-11-24 US disclosed
EP-0043937-B1 ANTHRAQUINONE-AZO COMPOUNDS, THEIR PREPARATION AND THEIR USE BAYER AG (DE) 1984-09-19 EP disclosed
EP-0058866-B1 ANTHRAQUINONE-AZO COMPOUNDS, THEIR PREPARATION AND USE BAYER AG (DE) 1984-07-18 EP disclosed
EP-0023617-B1 ANTHRAQUINONE-AZO COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PIGMENTS BAYER AG (DE) 1984-06-27 EP disclosed
US-4389215-A Anthraquinone-azomethine compounds, processes for their preparation and processes for dyeing synthetic fibre materials and for pigmenting organic macromolecular substances BAYER AKTIENGESELLSCHAFT (DE) 1983-06-21 US disclosed
EP-0023666-B1 ANTHRAQUINONE-AZOMETHINE COMPOUNDS, PROCESS FOR THEIR PREPARATION AS WELL AS A PROCESS FOR PIGMENTING ORGANIC MACROMOLECULAR MATERIALS BAYER AG (DE) 1982-10-13 EP disclosed
EP-0058866-A1 Anthraquinone-azo compounds, their preparation and use BAYER AG (DE) 1982-09-01 EP disclosed
EP-0023648-B1 ANTHRAQUINONE-AZOMETHINE COMPOUNDS, PROCESS FOR THEIR PREPARATION; PROCESS FOR DYEING SYNTHETIC FIBRE MATERIALS AS WELL AS FOR PIGMENTING ORGANIC MACROMOLECULAR MATERIALS BAYER AG (DE) 1982-06-23 EP disclosed
US-4323670-A Anthraquinone-azomethine compounds, processes for their preparation and processes for pigmenting organic macromolecular substances BAYER AKTIENGESELLSCHAFT (DE) 1982-04-06 US disclosed
US-4319025-A Anthraquinone-azomethine compounds, processes for their preparation and processes for dyeing synthetic fibre materials and for pigmenting organic macromolecular substances BAYER AKTIENGESELLSCHAFT (DE) 1982-03-09 US disclosed
EP-0043937-A2 Anthraquinone-azo compounds, their preparation and their use BAYER AG (DE) 1982-01-20 EP disclosed
EP-0023617-A1 Anthraquinone-azo compounds, process for their preparation and their use as pigments BAYER AG (DE) 1981-02-11 EP disclosed
EP-0023666-A1 Anthraquinone-azomethine compounds, process for their preparation as well as a process for pigmenting organic macromolecular materials BAYER AG (DE) 1981-02-11 EP disclosed
EP-0023648-A1 Anthraquinone-azomethine compounds, process for their preparation; process for dyeing synthetic fibre materials as well as for pigmenting organic macromolecular materials BAYER AG (DE) 1981-02-11 EP disclosed