SCHEMBL4196176

SCHEMBL4196176

CCCCCn1c(C)cc2cnc(Cl)nc21

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.39
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ADRA2A P08913 2/20 0.37
TLR8 Q9NR97 3/20 0.36
PDE4B Q07343 1/20 0.34
HSP90B1 P14625 1/20 0.34

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
SCHEMBL4189802 0.81 SIK1 (0.33) ENPP2HSP90B1
SCHEMBL4201281 0.80 CCR9 (0.39) KDM4EALDH1A1GAA
SCHEMBL4195721 0.80 CTSS (0.35) PDE4BHSP90B1
SCHEMBL4194383 0.79 CTSS (0.35) ENPP2HSP90B1
SCHEMBL4200629 0.78 CCNB2 (0.32) PDE4BHSP90B1
SCHEMBL7504710 0.77 CDK4 (0.56)
SCHEMBL28294705 0.77 CCNB2 (0.31) ENPP2PDE4BHSP90B1
SCHEMBL6808956 0.72 CDK4 (0.60)
SCHEMBL4187055 0.72 GLO1 (0.41) KDM4EALDH1A1KMT2ASMN1; SMN2TLR8
SCHEMBL4184836 0.71 PDE4A (0.43) SMN1; SMN2PDE4B

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
EP-2029145-A2 PYRROLOPYRIMIDINE COMPOUNDS AND THEIR USES Novartis Ag (CH) 2009-03-04 EP disclosed
WO-2007140222-A2 PYRROLOPYRIMIDINE COMPOUNDS AND THEIR USES NOVARTIS AG (CH) 2007-12-06 WO disclosed