SCHEMBL4547161

SCHEMBL4547161

O=C1c2ccc(Cc3ccc(Nc4ccccc4)cc3)cc2C(=O)N1c1ccc(Nc2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.64
GFER P55789 1/20 0.64
KMT2A Q03164 1/20 0.64
APP P05067 1/20 0.51
STAT3 P40763 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HSP90AA1 P07900 1/20 0.49
ESR1 P03372 1/20 0.47
MCHR1 Q99705 1/20 0.45
PPARA Q07869 2/20 0.45
PPARD Q03181 1/20 0.45
NR1H3 Q13133 3/20 0.44
SCN2A Q99250 1/20 0.43
ALDH1A1 P00352 2/20 0.43
POLB P06746 2/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43

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
SCHEMBL25899286 0.85 ESR1 (0.62) STAT3NPSR1ESR1PPARAPPARD
SCHEMBL2132967 0.82 KMT2A (0.68) MEN1GFERKMT2AAPPHSP90AA1
SCHEMBL15841150 0.81 MEN1 (0.64) MEN1GFERKMT2AAPPNPSR1
SCHEMBL10240992 0.80 MEN1 (0.67) MEN1GFERKMT2AAPPNPSR1
SCHEMBL14338928 0.79 RAB9A (0.65) MEN1GFERKMT2AALDH1A1POLB
SCHEMBL23775711 0.78 SCN2A (0.64) MEN1GFERKMT2ANPSR1HSP90AA1
SCHEMBL9480783 0.78 NR1H3 (0.66) MEN1KMT2ASTAT3NPSR1PPARA
SCHEMBL25918305 0.78 SCN2A (0.56) MEN1KMT2ASTAT3NPSR1PPARA
SCHEMBL10189837 0.78 KMT2A (1.00) MEN1GFERKMT2ANPSR1PPARA
SCHEMBL10189781 0.76 CA12 (0.64) MEN1GFERKMT2AAPPHSP90AA1

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
EP-2450348-A1 NOVEL DIARYLAMINE COMPOUND, AND ANTI-AGING AGENT, POLYMER COMPOSITION, CROSSLINKED RUBBER PRODUCT AND MOLDED ARTICLE THEREOF, AND METHOD FOR PRODUCING DIARYLAMINE COMPOUND Zeon Corporation (JP) 2012-05-09 EP disclosed