SCHEMBL6220539

SCHEMBL6220539

COc1ccc(C(=O)c2cn(C(C)C)c3ncnc(N)c23)cc1N(C(N)=O)c1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.55
NTRK1 P04629 6/20 0.50
NTRK2 Q16620 3/20 0.50
KCNH2 Q12809 3/20 0.50
NTRK3 Q16288 2/20 0.50
PDPK1 O15530 2/20 0.45
RET P07949 6/20 0.42
LCK P06239 4/20 0.41
SRC P12931 3/20 0.41
KDR P35968 5/20 0.40
TEK Q02763 3/20 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
SCHEMBL6223276 0.93 PDGFRB (0.46) PDGFRBNTRK1NTRK2KCNH2NTRK3
SCHEMBL6224467 0.92 NTRK1 (0.50) PDGFRBNTRK1NTRK2KCNH2NTRK3
SCHEMBL6223880 0.92 PDGFRB (0.49) PDGFRBNTRK1NTRK2KCNH2NTRK3
SCHEMBL6220911 0.91 PDGFRB (0.53) PDGFRBNTRK1NTRK2KCNH2NTRK3
SCHEMBL6221418 0.90 NTRK1 (0.52) PDGFRBNTRK1NTRK2KCNH2NTRK3
SCHEMBL5356447 0.88 PDGFRB (0.51) PDGFRBNTRK1NTRK2KCNH2NTRK3
SCHEMBL5350777 0.88 PDGFRB (0.49) PDGFRBNTRK1NTRK2KCNH2NTRK3
SCHEMBL6222445 0.88 NTRK1 (0.46) PDGFRBNTRK1NTRK2KCNH2NTRK3
SCHEMBL6220940 0.87 PDGFRB (0.48) PDGFRBNTRK1NTRK2KCNH2NTRK3
SCHEMBL6222997 0.87 NTRK1 (0.48) PDGFRBNTRK1NTRK2KCNH2NTRK3

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-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