SCHEMBL5183175

SCHEMBL5183175

Cc1cc(=O)[nH]n1-c1ccc(N/C=C2/C(=O)Nc3cc(-c4ccccc4)ccc32)cc1.O=C1Nc2cc(-c3ccccc3)ccc2/C1=C\Nc1ccc(I)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
KDR P35968 8/20 0.37
PDGFRB P09619 6/20 0.37
FGFR1 P11362 4/20 0.37
EGFR P00533 2/20 0.37
FLT4 P35916 3/20 0.37
FLT3 P36888 3/20 0.37
KIT P10721 2/20 0.37
CDK2 P24941 1/20 0.35
SRC P12931 2/20 0.35
CHEK1 O14757 6/20 0.34
AURKB Q96GD4 3/20 0.33
DAPK3 O43293 1/20 0.33
JAK2 O60674 1/20 0.33
MAP4K4 O95819 1/20 0.33
ABL1 P00519 1/20 0.33
NTRK1 P04629 1/20 0.33
LCK P06239 1/20 0.33
CSF1R P07333 1/20 0.33

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
SCHEMBL5183182 1.00 MAOA (0.38) MAOAMAOBKDRPDGFRBFGFR1
SCHEMBL5432281 0.95 MAOA (0.42) MAOAMAOBKDRPDGFRBFGFR1
SCHEMBL5432283 0.95 MAOA (0.42) MAOAMAOBKDRPDGFRBFGFR1
SCHEMBL5429372 0.86 MAOA (0.51) MAOAMAOBKDRPDGFRBFGFR1
SCHEMBL5429376 0.86 MAOA (0.51) MAOAMAOBKDRPDGFRBFGFR1
SCHEMBL7706676 0.82 RET (0.39) KDRFLT4FLT3KITCHEK1
SCHEMBL7706674 0.82 RET (0.39) KDRFLT4FLT3KITCHEK1
SCHEMBL5182966 0.81 PIM1 (0.40) KDRPDGFRBFLT4FLT3KIT
SCHEMBL5182964 0.81 PIM1 (0.40) KDRPDGFRBFLT4FLT3KIT
SCHEMBL5873921 0.78 JAK3 (0.38) KDRPDGFRBFGFR1FLT3CHEK1

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-1773309-A1 TAMOXIFEN RESPONSE IN PRE-AND POSTMENOPAUSAL BREAST CANCER PATIENTS Forskarpatent i Syd AB (SE) 2007-04-18 EP disclosed
WO-2006004545-A1 TAMOXIFEN RESPONSE IN PRE-AND POSTMENOPAUSAL BREAST CANCER PATIENTS FORSKARPATENT I SYD AB (SE) 2006-01-12 WO disclosed