SCHEMBL5070073

SCHEMBL5070073

COc1cc2cccnc2cc1OCC1CCN(C)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.59
PDGFRA P16234 2/20 0.59
PDPK1 O15530 1/20 0.53
EGFR P00533 13/20 0.52
DNMT1 P26358 1/20 0.51
EHMT2 Q96KQ7 1/20 0.51
KIT P10721 2/20 0.48
PDE3B Q13370 2/20 0.48
PDE3A Q14432 2/20 0.48
PDE10A Q9Y233 2/20 0.48
KDR P35968 3/20 0.48
SRC P12931 2/20 0.48
FGFR1 P11362 2/20 0.48
FLT1 P17948 2/20 0.48
FLT4 P35916 2/20 0.48
BMPR1B O00238 1/20 0.48
PLK4 O00444 1/20 0.48
CIT O14578 1/20 0.48
GAK O14976 1/20 0.48
EPHB6 O15197 1/20 0.48

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
SCHEMBL4377364 0.81 PDE3B (0.61) EGFRPDE3BPDE3APDE10AKDR
SCHEMBL2925101 0.81 PDE3B (0.61) EGFRPDE3BPDE3APDE10AKDR
SCHEMBL30288390 0.81 PDPK1 (0.53) PDGFRBPDGFRAPDPK1EGFRKIT
SCHEMBL24444648 0.79 PDGFRB (0.59) PDGFRBPDGFRAPDPK1EGFRDNMT1
SCHEMBL7493881 0.78 KDM4E (0.60) PDPK1EGFRDNMT1EHMT2KDR
SCHEMBL4299023 0.77 PDGFRB (1.00) PDGFRBPDGFRAPDE10A
SCHEMBL30136402 0.76 PDGFRB (0.56) PDGFRBPDGFRADNMT1EHMT2MET
Hydrochloric Acid SCHEMBL29357672 0.76 PDGFRB (0.96) PDGFRBPDGFRAPDE10A
SCHEMBL8264497 0.75 DNMT1 (0.48) PDGFRBPDGFRAPDPK1EGFRDNMT1
SCHEMBL8306125 0.75 EHMT2 (0.53) PDGFRBPDGFRAPDPK1EGFREHMT2

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
US-20080268460-A1 Assays to Identify Irreversibly Binding Inhibitors of Receptor Tyrosine Kinases WYETH (US) 2008-10-30 US disclosed