SCHEMBL5745314

SCHEMBL5745314

CCCCCCc1ccnc(Nc2ncccn2)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LPL P06858 2/20 0.40
LIPG Q9Y5X9 2/20 0.40
PPARG P37231 1/20 0.38
PPARA Q07869 1/20 0.38
HPGD P15428 1/20 0.38
GPR3 P46089 1/20 0.38
ALOX12 P18054 1/20 0.37
MME P08473 1/20 0.37

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
SCHEMBL5750072 1.00 KDM4E (0.42) KDM4ETDP1L3MBTL1LPLLIPG
SCHEMBL5746333 1.00 KDM4E (0.42) KDM4ETDP1L3MBTL1LPLLIPG
SCHEMBL5746344 0.94 MME (0.41) KDM4ETDP1L3MBTL1HPGDMME
SCHEMBL5745899 0.88 NR3C2 (0.40)
SCHEMBL5748565 0.87 ALOX12 (0.45) KDM4ETDP1L3MBTL1LPLLIPG
SCHEMBL5749197 0.84 KCNH3 (0.44) KDM4ETDP1L3MBTL1PPARGPPARA
SCHEMBL5750951 0.84 KCNH3 (0.44) KDM4ETDP1L3MBTL1PPARGPPARA
SCHEMBL5748767 0.84 KCNH3 (0.44) KDM4ETDP1L3MBTL1PPARGPPARA
SCHEMBL5748770 0.81 LMNA (0.42) KDM4ETDP1L3MBTL1HPGD
SCHEMBL5748820 0.81 NOS2 (0.52) KDM4EHPGD

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