SCHEMBL6090338

SCHEMBL6090338

O=C1NN=C(OC2CC2)C1=Cc1cc(Br)c[nH]1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 1/20 0.32

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
SCHEMBL6090329 1.00 MAP4K1 (0.32) MAP4K1
SCHEMBL6089208 0.85
SCHEMBL6087575 0.81 MAP4K1 (0.34) MAP4K1
SCHEMBL6087571 0.81 MAP4K1 (0.34) MAP4K1
SCHEMBL6091586 0.79 TLK2 (0.34) MAP4K1
SCHEMBL6091588 0.79 TLK2 (0.34) MAP4K1
SCHEMBL6092000 0.78 MAP4K1 (0.33) MAP4K1
SCHEMBL6091997 0.78 MAP4K1 (0.33) MAP4K1
SCHEMBL6088546 0.78 ALDH1A1 (0.34)
SCHEMBL6092325 0.77 PDPK1 (0.44)

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