SCHEMBL6052132

SCHEMBL6052132

CC(CCCc1ccccc1)n1cnc2c(=O)[nH]c(Cc3ccc(-c4ccsc4)cc3)nc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 4/20 0.51
KDM4E B2RXH2 4/20 0.39
HSD17B10 Q99714 2/20 0.39
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 3/20 0.37
HPGD P15428 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CCNE2 O96020 1/20 0.36
CCNA2 P20248 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 1/20 0.36
CCNA1 P78396 1/20 0.36
ADORA3 P0DMS8 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
ADORA1 P30542 1/20 0.33
KMT2A Q03164 1/20 0.33
BRD4 O60885 1/20 0.33

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
SCHEMBL6051959 0.89 PDE2A (0.63) PDE2AKDM4EADORA3KMT2A
SCHEMBL7436632 0.86 PDE2A (0.53) PDE2AKDM4EHSD17B10TSHRNPSR1
SCHEMBL7442300 0.85 PDE2A (0.57) PDE2ACCNE2CCNE1CDK2ADORA3
SCHEMBL7436563 0.85 PDE2A (0.57) PDE2ACCNE2CCNE1CDK2ADORA3
SCHEMBL6051965 0.85 PDE2A (0.57) PDE2AHPGDADORA3KMT2A
SCHEMBL6051979 0.84 PDE2A (0.53) PDE2ACCNE2CCNA2CCNE1CDK2
SCHEMBL6052136 0.81 CDK1 (0.38) CCNE2CCNA2CCNE1CDK2CCNA1
SCHEMBL7440929 0.81 PDE2A (0.54) PDE2ACCNE2CCNE1CDK2
SCHEMBL7442320 0.79 PDE2A (0.52) PDE2AKDM4EALDH1A1CCNE2CCNA2
SCHEMBL6052100 0.79 PDE2A (0.44) PDE2AKDM4EALDH1A1HPGDCCNE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060229242-A1 Composition comprising a pulmonary surfactant and a pde2 inhibitor ALTANA PHAZMA AG (DE) 2006-10-12 US claimed
EP-1660132-A1 COMPOSITION COMPRISING A PULMONARY SURFACTANT AND A PDE2 INHIBITOR ALTANA Pharma AG (DE) 2006-05-31 EP claimed
WO-2005021037-A1 COMPOSITION COMPRISING A PULMONARY SURFACTANT AND A PDE2 INHIBITOR ALTANA PHARMA AG (DE) 2005-03-10 WO claimed
US-20060229242-A1 Composition comprising a pulmonary surfactant and a pde2 inhibitor ALTANA PHAZMA AG (DE) 2006-10-12 US disclosed
EP-1660132-A1 COMPOSITION COMPRISING A PULMONARY SURFACTANT AND A PDE2 INHIBITOR ALTANA Pharma AG (DE) 2006-05-31 EP disclosed
WO-2005021037-A1 COMPOSITION COMPRISING A PULMONARY SURFACTANT AND A PDE2 INHIBITOR ALTANA PHARMA AG (DE) 2005-03-10 WO disclosed