SCHEMBL18214723

SCHEMBL18214723

CCCC(=N)n1c(=N)c(=O)[nH]c2cc(C(=O)N(Cc3ccccc3)Cc3ccccc3)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRPF1 P55201 2/20 0.43
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
THRB P10828 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
DRD2 P14416 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HTT P42858 1/20 0.38
PPARG P37231 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL18214704 0.83 TP53 (0.51) BRPF1KMT2AMEN1RXFP1KDM4E
SCHEMBL18214692 0.81 TP53 (0.46) KMT2AMEN1RXFP1KDM4EALDH1A1
SCHEMBL18214707 0.81 TP53 (0.46) KMT2AMEN1RXFP1L3MBTL1KDM4E
SCHEMBL7904385 0.72 GRIN2D (0.52) BRPF1KMT2AMEN1L3MBTL1KDM4E
SCHEMBL7898918 0.69 GRIN2D (0.48) BRPF1KMT2AMEN1KDM4EALDH1A1
SCHEMBL7905039 0.69 GRIN2D (0.50) BRPF1KMT2AMEN1THRBRXFP1
SCHEMBL7907679 0.69 GRIN2D (0.47) BRPF1KMT2AMEN1
SCHEMBL7908241 0.68 GRIN2D (0.46) BRPF1KMT2AMEN1RXFP1ALDH1A1
SCHEMBL7905764 0.68 GRIN2D (0.46) BRPF1KMT2AMEN1L3MBTL1KDM4E
SCHEMBL14826760 0.68 GRIN2D (0.46) BRPF1KMT2AMEN1L3MBTL1KDM4E

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-2404922-B1 QUINOXALINE COMPOUNDS ASTELLAS PHARMA INC (JP) 2016-11-09 EP disclosed