SCHEMBL5749079

SCHEMBL5749079

CCc1cc(N)c2ccc3cccc4ccc1c2c34

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
ALDH1A1 P00352 7/20 0.40
HPGD P15428 4/20 0.40
HSD17B10 Q99714 3/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CYP1A2 P05177 3/20 0.38
CYP1B1 Q16678 2/20 0.38
CYP1A1 P04798 1/20 0.38
ERBB2 P04626 1/20 0.38
FYN P06241 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38
AHR P35869 1/20 0.38
HPRT1 P00492 1/20 0.38
PARP1 P09874 1/20 0.37
KDM4E B2RXH2 5/20 0.36

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
SCHEMBL5750664 0.90 CYP1A2 (0.40) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL5748193 0.83 CYP1A2 (0.43) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL5746315 0.82 TLR8 (0.43) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL5745410 0.82 TLR8 (0.43) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL5746608 0.82 TLR8 (0.43) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL4018577 0.81 ALDH1A1 (0.52) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL30982344 0.81 ALDH1A1 (0.55) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL5748017 0.79 PARP1 (0.44) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL2167122 0.79 KMT2A (0.44) KMT2AMEN1ALDH1A1HPGDHSD17B10
SCHEMBL27705873 0.78 CYP1A2 (0.52) KMT2AMEN1ALDH1A1HPGDHSD17B10

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