SCHEMBL5202877

SCHEMBL5202877

COc1ccc(-c2cnc(C(C)C(O)=S)nc2)cc1OC

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.48
PDGFRA P16234 1/20 0.48
GAK O14976 11/20 0.44
FYN P06241 2/20 0.43
CHEK1 O14757 1/20 0.42
CHEK2 O96017 1/20 0.42
KIT P10721 1/20 0.42
DYRK1A Q13627 1/20 0.42
AAK1 Q2M2I8 2/20 0.41
CYP17A1 P05093 1/20 0.41
HPGDS O60760 1/20 0.40

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
SCHEMBL7161673 0.86 CHEK1 (0.48) PDGFRBPDGFRAGAKFYNCHEK1
SCHEMBL5202857 0.82 CHEK1 (0.47) PDGFRBPDGFRAGAKFYNCHEK1
SCHEMBL5203300 0.75 PDGFRB (0.49) PDGFRBPDGFRAGAKFYNCHEK1
SCHEMBL5202865 0.73 PDGFRB (0.47) PDGFRBPDGFRAGAKFYNCHEK1
SCHEMBL3769943 0.72 PDGFRB (0.58) PDGFRBPDGFRAGAKFYNCHEK1
SCHEMBL6029081 0.72 PDGFRB (0.58) PDGFRBPDGFRAGAKFYNCHEK1
SCHEMBL8840880 0.70 PDE4A (0.67) PDGFRBPDGFRA
SCHEMBL5832416 0.69 PDGFRB (0.55) PDGFRBPDGFRAGAKFYNCHEK1
SCHEMBL11046284 0.69 PDE4A (0.57) PDGFRBPDGFRACHEK1CHEK2AAK1
SCHEMBL14974281 0.68 PDGFRB (0.58) PDGFRBPDGFRAGAKFYNKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358181-B1 SUBSTITUTED PYRROLIDINES AS CCR-3 RECEPTOR ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-09-26 EP disclosed
EP-1358181-A1 SUBSTITUTED PYRROLIDINES AS CCR-3 RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2003-11-05 EP disclosed
WO-2002050064-A1 SUBSTITUTED PYRROLIDINES AS CCR-3 RECEPTOR ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2002-06-27 WO disclosed