SCHEMBL5771541

SCHEMBL5771541

Cc1cc2ccc(Nc3ccccn3)c3ccc4cccc1c4c23

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.44
MAPK10 P53779 3/20 0.44
MEN1 O00255 2/20 0.44
GFER P55789 1/20 0.44
TSHR P16473 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
CYP3A4 P08684 1/20 0.41
HSD17B10 Q99714 1/20 0.41
APAF1 O14727 1/20 0.40
TDP2 O95551 1/20 0.40
CDC25B P30305 1/20 0.40
CASP6 P55212 1/20 0.40
RCE1 Q9Y256 1/20 0.40
ACP1 P24666 1/20 0.40
KDM4E B2RXH2 4/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39

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
SCHEMBL5771888 0.95 MAPK10 (0.44) KMT2AMAPK10MEN1GFERTSHR
SCHEMBL5770706 0.87 KMT2A (0.46) KMT2AMAPK10MEN1GFERTSHR
SCHEMBL5749052 0.86 KMT2A (0.55) KMT2AMAPK10MEN1GFERTSHR
SCHEMBL5778071 0.85 TSHR (0.41) KMT2AMAPK10MEN1GFERTSHR
SCHEMBL5777744 0.82 GRM5 (0.47) KMT2AMAPK10MEN1GFERTSHR
SCHEMBL5774898 0.82 KMT2A (0.46) KMT2AMAPK10MEN1GFERTSHR
SCHEMBL5772841 0.82 TSHR (0.42) KMT2AMAPK10MEN1GFERTSHR
SCHEMBL5777479 0.81 KMT2A (0.40) KMT2AMAPK10MEN1GFERTSHR
SCHEMBL5780874 0.79 ACP1 (0.45) KMT2AMAPK10MEN1GFERTSHR
SCHEMBL5772124 0.76 MAPK10 (0.43) KMT2AMAPK10MEN1GFERTSHR

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
US-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 EP disclosed