SCHEMBL6223276

SCHEMBL6223276

COc1ccc(N(C(N)=O)c2cc(C(=O)c3cn(C(C)C)c4ncnc(N)c34)ccc2OC)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.46
KDR P35968 8/20 0.44
LCK P06239 6/20 0.44
TEK Q02763 6/20 0.44
NTRK1 P04629 5/20 0.43
NTRK2 Q16620 3/20 0.43
NTRK3 Q16288 2/20 0.43
PDPK1 O15530 1/20 0.43
KCNH2 Q12809 3/20 0.42
RET P07949 6/20 0.42
SRC P12931 4/20 0.40
EGFR P00533 2/20 0.39
PIK3CD O00329 1/20 0.39
ABL1 P00519 1/20 0.39
HCK P08631 1/20 0.39
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
MTOR P42345 1/20 0.39
PIK3CG P48736 1/20 0.39
EPHB4 P54760 1/20 0.39

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
SCHEMBL6224467 0.93 NTRK1 (0.50) PDGFRBKDRLCKTEKNTRK1
SCHEMBL6220539 0.93 PDGFRB (0.55) PDGFRBKDRLCKTEKNTRK1
SCHEMBL6223880 0.93 PDGFRB (0.49) PDGFRBKDRLCKTEKNTRK1
SCHEMBL6220940 0.91 PDGFRB (0.48) PDGFRBKDRLCKTEKNTRK1
SCHEMBL6221418 0.91 NTRK1 (0.52) PDGFRBKDRLCKTEKNTRK1
SCHEMBL5350777 0.88 PDGFRB (0.49) PDGFRBKDRLCKTEKNTRK1
SCHEMBL6222445 0.88 NTRK1 (0.46) PDGFRBKDRLCKTEKNTRK1
SCHEMBL6220911 0.87 PDGFRB (0.53) PDGFRBKDRLCKTEKNTRK1
SCHEMBL6222997 0.87 NTRK1 (0.48) PDGFRBKDRLCKTEKNTRK1
SCHEMBL5364437 0.86 NTRK1 (0.48) PDGFRBKDRLCKTEKNTRK1

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
EP-1578751-A1 PYRROLOPYRIMIDINE DERIVATIVES Pfizer Products Inc. (US) 2005-09-28 EP claimed
WO-2004056830-A1 PYRROLOPYRIMIDINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2004-07-08 WO claimed
EP-1578751-A1 PYRROLOPYRIMIDINE DERIVATIVES Pfizer Products Inc. (US) 2005-09-28 EP disclosed
WO-2004056830-A1 PYRROLOPYRIMIDINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2004-07-08 WO disclosed