SCHEMBL6090365

SCHEMBL6090365

CCN(CC)C(C)c1c(C)[nH]c(/C=C2/C(=O)NN=C2c2cnccn2)c1C

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.66
CHEK1 O14757 2/20 0.66

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
SCHEMBL6088780 0.86 KDR (0.49) KDRCHEK1
SCHEMBL6089341 0.84 KDR (0.46) KDRCHEK1
SCHEMBL6090277 0.84 KDR (0.47) KDRCHEK1
SCHEMBL6089250 0.83 KDR (0.45) KDRCHEK1
SCHEMBL6090063 0.83 KDR (0.45) KDRCHEK1
SCHEMBL6092863 0.82 KDR (0.44) KDRCHEK1
SCHEMBL6088519 0.81 KDR (0.43) KDRCHEK1
SCHEMBL6090731 0.81 KDR (0.77) KDRCHEK1
SCHEMBL6090724 0.81 KDR (0.77) KDRCHEK1
SCHEMBL6090954 0.81 KDR (0.82) KDRCHEK1

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-7060822-B1 2-pyrazolin-5-ones ABBOTT GMBH & CO. KG (DE) 2006-06-13 US disclosed