SCHEMBL6091867

SCHEMBL6091867

O=C1NN=C(c2ncc[nH]2)C1=Cc1ccc(C(F)(F)F)[nH]1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.31
TLK2 Q86UE8 1/20 0.30

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
SCHEMBL6091863 1.00 KDR (0.31) KDRTLK2
SCHEMBL6092139 0.82 KDR (0.32) KDRTLK2
SCHEMBL6092135 0.82 KDR (0.32) KDRTLK2
SCHEMBL6089687 0.78 KDR (0.54) KDR
SCHEMBL6089692 0.78 KDR (0.54) KDR
SCHEMBL6090871 0.78 PDPK1 (0.45) KDRTLK2
SCHEMBL6090867 0.78 PDPK1 (0.45) KDRTLK2
SCHEMBL6090381 0.76 ALK (0.41) KDR
SCHEMBL6090385 0.76 ALK (0.41) KDR
SCHEMBL6088541 0.74 KDR (0.33) 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 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