SCHEMBL27535083

SCHEMBL27535083

COc1nc2cc(F)cc(CCBr)c2nc1OC

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PKM P14618 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
SCHEMBL5973480 0.88 PKM (0.32) PKM
SCHEMBL27462046 0.83 NQO2 (0.39)
SCHEMBL27513154 0.82 HRH4 (0.32)
SCHEMBL5973108 0.81 PDCD1LG2 (0.35) PKM
SCHEMBL28742541 0.78
SCHEMBL27440732 0.76 NQO2 (0.38)
SCHEMBL27462471 0.75 NQO2 (0.38) PKM
SCHEMBL5973377 0.74 RECQL (0.35) PKM
SCHEMBL8086933 0.74 SIRT2 (0.35)
SCHEMBL5973164 0.70 NQO2 (0.41)

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
CN-1234037-A Subsd. aminoalkane phosphonic acids NOVARTIS AG (CH) 1999-11-03 CN disclosed