SCHEMBL14217352

SCHEMBL14217352

COc1cc2nccc(C)c2cc1C#N

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.45
ERBB2 P04626 5/20 0.45
IMPDH2 P12268 1/20 0.45
IMPDH1 P20839 1/20 0.45
MET P08581 1/20 0.44
AXL P30530 1/20 0.44
SRC P12931 5/20 0.44
AR P10275 4/20 0.43
MAP2K1 Q02750 1/20 0.42

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
SCHEMBL19957128 0.89 MET (0.52) EGFRERBB2IMPDH2IMPDH1MET
SCHEMBL14540937 0.85 SRC (0.44) EGFRERBB2SRCAR
SCHEMBL1895913 0.84 SRC (0.50) EGFRERBB2SRC
SCHEMBL24009286 0.84 MAP2K1 (0.46) EGFRERBB2IMPDH2IMPDH1MET
Hydrochloric Acid SCHEMBL6432114 0.82 SRC (0.49) EGFRERBB2SRC
SCHEMBL1496287 0.82 PDGFRB (0.57) EGFRSRC
SCHEMBL12503594 0.80 PDGFRB (0.47) EGFRSRC
SCHEMBL4299967 0.80 SRC (0.52) EGFRERBB2SRCMAP2K1
Methane SCHEMBL24557063 0.79 PDGFRB (0.46) EGFRSRC
SCHEMBL17136805 0.78 SRC (0.50) EGFRERBB2SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7371765-B2 Quinoline derivatives having VEGF inhibiting activity ASTRAZENECA AB (SE) 2008-05-13 US disclosed