SCHEMBL7211368

SCHEMBL7211368

COCCOc1cc2ncnc(C3C(=O)Nc4ccc([N+](=O)[O-])cc43)c2cc1OC

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.43
KDR P35968 15/20 0.41
ACHE P22303 1/20 0.41
BACE1 P56817 1/20 0.41
FGFR1 P11362 1/20 0.38
FLT1 P17948 1/20 0.38
FBP1 P09467 1/20 0.38

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
Hydrochloric Acid SCHEMBL7210042 0.99 ABCG2 (0.43) ABCG2KDRACHEBACE1FGFR1
SCHEMBL7206417 0.87 CHEK1 (0.44) KDRFGFR1FLT1
SCHEMBL7205577 0.86 KDR (0.46) KDRFGFR1FLT1
SCHEMBL7210197 0.86 FBP1 (0.51) KDRFGFR1FLT1FBP1
SCHEMBL7207042 0.85 CHEK1 (0.52) ABCG2KDRBACE1FGFR1FLT1
SCHEMBL7207079 0.85 KDR (0.44) KDR
Hydrochloric Acid SCHEMBL7212131 0.85 CHEK1 (0.51) ABCG2KDRBACE1FGFR1FLT1
SCHEMBL7205793 0.85 KDR (0.48) KDRFGFR1FLT1FBP1
Hydrochloric Acid SCHEMBL7210078 0.84 KDR (0.43) KDR
Hydrochloric Acid SCHEMBL7209976 0.84 KDR (0.47) KDR

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-0912557-B1 OXINDOLE DERIVATIVES ASTRAZENECA AB (SE) 2003-07-09 EP disclosed
EP-0912557-A1 OXINDOLE DERIVATIVES ZENECA LIMITED (GB) 1999-05-06 EP disclosed
WO-1997042187-A1 OXINDOLE DERIVATIVES ZENECA LIMITED (GB) 1997-11-13 WO disclosed