SCHEMBL5598445

SCHEMBL5598445

COc1cc(Oc2ccnc3cccnc23)ccc1CC(=O)Nc1nc(C)cs1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 15/20 0.55
CSF1R P07333 12/20 0.55
KDR P35968 10/20 0.55
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.49
MAPK10 P53779 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
FLT3 P36888 3/20 0.49
RAB9A P51151 2/20 0.48
ALDH1A1 P00352 1/20 0.48
MET P08581 2/20 0.47
PDGFRA P16234 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL5598961 0.89 PDGFRB (0.54) PDGFRBCSF1RKDRKDM4ELMNA
SCHEMBL2176728 0.89 PDGFRB (0.62) PDGFRBCSF1RKDRFLT3RAB9A
SCHEMBL5598616 0.83 PDGFRB (0.62) PDGFRBCSF1RKDRFLT3RAB9A
SCHEMBL2173476 0.83 PDGFRB (0.67) PDGFRBCSF1RKDRFLT3MET
SCHEMBL2172313 0.81 PDGFRB (0.57) PDGFRBCSF1RKDRFLT3MET
SCHEMBL5598353 0.80 PDGFRB (0.46) PDGFRBCSF1RKDRFLT3MET
SCHEMBL2176128 0.76 MET (0.64) PDGFRBCSF1RKDRKDM4ELMNA
SCHEMBL5598742 0.75 CSF1R (0.80) PDGFRBCSF1RKDRLMNAMAPK10
SCHEMBL2175586 0.72 MET (0.57) PDGFRBCSF1RKDRKDM4ELMNA
SCHEMBL2173153 0.72 SMN1; SMN2 (0.55) PDGFRBCSF1RKDRKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007113548-A1 NAPHTHYRIDINE DERIVATIVES ASTRAZENECA AB (SE) 2007-10-11 WO disclosed