SCHEMBL6090618

SCHEMBL6090618

Cc1[nH]c(C=C2C(=O)NN=C2C2CC2)cc1CN(C)C

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PLAT P00750 1/20 0.32
KDR P35968 1/20 0.31
ATP4A P20648 1/20 0.31
ATP4B P51164 1/20 0.31

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
SCHEMBL6090610 1.00 PLAT (0.32) PLATKDRATP4AATP4B
SCHEMBL6092129 0.82 KDR (0.34) KDR
SCHEMBL6092131 0.82 KDR (0.34) KDR
SCHEMBL6088734 0.77 KDR (0.37) KDR
SCHEMBL6090016 0.77 KDM4E (0.34)
SCHEMBL6090023 0.77 KDM4E (0.34)
SCHEMBL6088730 0.77 KDR (0.37) KDR
SCHEMBL6090284 0.77 CHEK1 (0.47) KDR
SCHEMBL6090290 0.77 CHEK1 (0.47) KDR
SCHEMBL6087969 0.76 LRRK2 (0.32)

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