SCHEMBL6423045

SCHEMBL6423045

CCOC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(Br)cc32)c1-c1ccccc1.O=C1Cc2cc(Br)ccc2N1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 8/20 0.54
FGFR1 P11362 6/20 0.54
RET P07949 2/20 0.54
ALK Q9UM73 2/20 0.54
ABL1 P00519 1/20 0.54
FLT3 P36888 1/20 0.54
KDR P35968 8/20 0.51
EGFR P00533 2/20 0.48
AURKA O14965 2/20 0.43
SRC P12931 1/20 0.43
KIT P10721 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
PRKAA2 P54646 1/20 0.41
PRKAA1 Q13131 1/20 0.41
CCNB2 O95067 1/20 0.40
CDK1 P06493 1/20 0.40
HSP90AA1 P07900 1/20 0.40
CCNB1 P14635 1/20 0.40
CCR6 P51684 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
SCHEMBL2115533 0.92 PDGFRB (0.62) PDGFRBFGFR1RETALKABL1
SCHEMBL2115532 0.92 PDGFRB (0.62) PDGFRBFGFR1RETALKABL1
SCHEMBL29016217 0.85 LMNA (0.46) PDGFRBFGFR1RETALKABL1
SCHEMBL3804361 0.81 KDR (0.59) PDGFRBFGFR1RETALKABL1
SCHEMBL3720975 0.81 KDR (0.59) PDGFRBFGFR1RETALKABL1
SCHEMBL5392303 0.80 PDGFRB (0.74) PDGFRBFGFR1RETALKABL1
SCHEMBL6391494 0.79 FGFR1 (0.72) PDGFRBFGFR1RETALKABL1
SCHEMBL6391497 0.79 FGFR1 (0.72) PDGFRBFGFR1RETALKABL1
SCHEMBL23064738 0.78 ALDH1A1 (0.43) PDGFRBFGFR1RETALKABL1
SCHEMBL23064739 0.78 ALDH1A1 (0.43) PDGFRBFGFR1RETALKABL1

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-1427326-A4 COMBINATION THERAPY FOR THE TREATMENT OF CANCER SUGEN INC (US) 2005-06-08 EP disclosed
EP-1427326-A2 COMBINATION THERAPY FOR THE TREATMENT OF CANCER Sugen, Inc. (US) 2004-06-16 EP disclosed
WO-2003015608-A2 COMBINATION THERAPY FOR THE TREATMENT OF CANCER SUGEN, INC. (US) 2003-02-27 WO disclosed