SCHEMBL3338377

SCHEMBL3338377

Oc1ccccc1-c1nc2cccnc2[nH]1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.59
KDM4E B2RXH2 4/20 0.55
HPGD P15428 2/20 0.55
GUSB P08236 1/20 0.55
RIPK1 Q13546 1/20 0.55
CDK1 P06493 2/20 0.53
CCNB2 O95067 1/20 0.53
CCNB1 P14635 1/20 0.53
GSK3A P49840 1/20 0.53
GSK3B P49841 1/20 0.53
CDK5 Q00535 1/20 0.53
CDK5R1 Q15078 1/20 0.53
CCNB3 Q8WWL7 1/20 0.53
F7 P08709 1/20 0.50
KDR P35968 1/20 0.49
CDK2 P24941 1/20 0.48
MKNK1 Q9BUB5 1/20 0.48
MKNK2 Q9HBH9 1/20 0.48
IDO1 P14902 2/20 0.45
MGAM O43451 2/20 0.45

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
SCHEMBL15633796 0.80 NPC1 (0.46) KDM4EHPGDCDK1CCNB2CCNB1
SCHEMBL30802382 0.79 MKNK1 (0.69) KDM4EHPGDRIPK1CDK1CDK2
SCHEMBL10740734 0.79 PDE5A (0.65) PDE5AKDM4EHPGDGUSBRIPK1
SCHEMBL30874526 0.79 MKNK1 (0.69) KDM4EHPGDRIPK1CDK1CDK2
SCHEMBL26227556 0.79 MKNK1 (0.69) KDM4EHPGDRIPK1CDK1CDK2
SCHEMBL2191709 0.77 MKNK1 (0.68) KDM4EHPGDCDK1CDK2MKNK1
SCHEMBL461968 0.76 F7 (0.79) PDE5AKDM4EHPGDGUSBCDK1
SCHEMBL29578227 0.76 F7 (0.79) PDE5AKDM4EHPGDGUSBCDK1
SCHEMBL2668125 0.76 NPC1 (0.56) KDM4EHPGDCDK1CCNB2CCNB1
SCHEMBL5246817 0.75 KDM4E (0.53) PDE5AKDM4EHPGDGUSBCDK1

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
US-20100151234-A1 Penetration Resistant Composite and Article Comprising Same E. I. DU PONT DE NEMOURS AND COMPANY 2010-06-17 US disclosed
CN-101283232-A Penetration resistant composite and article comprising same DU PONT (US) 2008-10-08 CN disclosed
EP-1920210-A2 PENETRATION RESISTANT COMPOSITE AND ARTICLE COMPRISING SAME E.I.Du pont de nemours and company (US) 2008-05-14 EP disclosed
WO-2007133238-A2 PENETRATION RESISTANT COMPOSITE AND ARTICLE COMPRISING SAME E.I. DU PONT DE NEMOURS AND COMPANY (US) 2007-11-22 WO disclosed