SCHEMBL627332

SCHEMBL627332

COc1ccc(NC(=O)Nc2cccc3nsnc23)cc1C(=O)NCCCN

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.49
KDM4E B2RXH2 6/20 0.49
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
ALDH1A1 P00352 5/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
NPSR1 Q6W5P4 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HPGD P15428 6/20 0.47
HTT P42858 2/20 0.47
POLB P06746 2/20 0.46
GAA P10253 2/20 0.46
TP53 P04637 2/20 0.45
LMNA P02545 3/20 0.43
PPARG P37231 1/20 0.42
NCOA2 Q15596 1/20 0.42
NCOA1 Q15788 1/20 0.42
NCOA3 Q9Y6Q9 1/20 0.42

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
SCHEMBL625245 0.83 MEN1 (0.58) MAPTMEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL624269 0.80 HTT (0.47) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL10083535 0.79 DDX3X (0.49) MAPTMEN1KMT2AMCHR1HDAC3
SCHEMBL625028 0.78 DYRK1A (0.52) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL625901 0.78 NPC1 (0.57) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL10083543 0.77 MCHR1 (0.47) GAAMCHR1MCHR2
SCHEMBL625266 0.76 MCHR1 (0.51) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL625958 0.76 SMN1; SMN2 (0.60) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL623943 0.76 MEN1 (0.51) MAPTKDM4EMEN1KMT2AALDH1A1
SCHEMBL10083554 0.75 KMT2A (0.44) MAPTKMT2AALDH1A1POLBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012020080-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY II GRAFFINITY PHARMACEUTICALS GMBH (DE) 2012-02-16 WO disclosed
WO-2012020080-A2 LIGANDS FOR ANTIBODY AND Fc-FUSION PROTEIN PURIFICATION BY AFFINITY CHROMATOGRAPHY II GRAFFINITY PHARMACEUTICALS GMBH (DE) 2012-02-16 WO disclosed