SCHEMBL4699223

SCHEMBL4699223

N=C(NCc1ccccc1)NN=Cc1ccc(O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.56
MMP1 P03956 1/20 0.52
MMP2 P08253 1/20 0.52
MMP9 P14780 1/20 0.52
MAPT P10636 5/20 0.51
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.51
ALDH1A1 P00352 4/20 0.51
KDM4E B2RXH2 4/20 0.51
HPGD P15428 3/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2D6 P10635 2/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51
LMNA P02545 2/20 0.51
TDP1 Q9NUW8 1/20 0.51
ALOX12 P18054 2/20 0.49
CYP3A4 P08684 1/20 0.49
RECQL P46063 1/20 0.49

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
SCHEMBL4699217 1.00 MIF (0.56) MIFMMP1MMP2MMP9MAPT
SCHEMBL4702924 0.82 LMNA (0.53) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL4700187 0.82 MAPT (0.60) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL4700007 0.82 MAPT (0.60) MAPTKMT2AMEN1ALDH1A1KDM4E
Iodide SCHEMBL11584757 0.80 MAPT (0.46) MAPTKMT2AMEN1ALDH1A1KDM4E
Iodide SCHEMBL11584755 0.80 MAPT (0.46) MAPTKMT2AMEN1ALDH1A1KDM4E
Iodide SCHEMBL11297268 0.79 CYP2C19 (0.48) MAPTKMT2AMEN1ALDH1A1KDM4E
SCHEMBL23709431 0.79 MEN1 (0.66) MIFMAPTKMT2AMEN1ALDH1A1
Hydrochloric Acid SCHEMBL17560945 0.78 MEN1 (0.63) MIFMAPTKMT2AMEN1ALDH1A1
SCHEMBL11582865 0.76 CYP1A2 (0.68) MAPTKMT2AMEN1KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1309544-B1 COMPOUNDS ACTING AS MELANOCORTIN RECEPTOR LIGANDS ACURE PHARMA AB (SE) 2008-11-05 EP claimed
US-7153881-B2 Compounds acting as melanocortin receptor ligands ACURE PHARMA AB (SE) 2006-12-26 US claimed
EP-1309544-B1 COMPOUNDS ACTING AS MELANOCORTIN RECEPTOR LIGANDS ACURE PHARMA AB (SE) 2008-11-05 EP disclosed
US-7153881-B2 Compounds acting as melanocortin receptor ligands ACURE PHARMA AB (SE) 2006-12-26 US disclosed