SCHEMBL3837174

SCHEMBL3837174

CCOCc1cc(I)c2c(c1)CNC2=O

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.34

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
SCHEMBL3837163 0.89 KDR (0.35) KDR
SCHEMBL3839331 0.85 KDR (0.32) KDR
SCHEMBL3837161 0.82 KDR (0.39) KDR
SCHEMBL3836776 0.77 AURKA (0.34) KDR
SCHEMBL3836958 0.77 PARP1 (0.36)
SCHEMBL3837343 0.72 L3MBTL1 (0.39)
SCHEMBL3839269 0.71 AR (0.31)
SCHEMBL3834414 0.71 PARP1 (0.48) KDR
SCHEMBL3835801 0.71 ELANE (0.37) KDR
SCHEMBL3837642 0.71 PARP1 (0.37) 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
EP-2108642-A1 JAK INHIBITOR Kyowa Hakko Kirin Co., Ltd. (JP) 2009-10-14 EP disclosed