SCHEMBL28111070

SCHEMBL28111070

[CH2]c1ccc(F)c(N(C)C2CC2)c1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.31
CRBN Q96SW2 1/20 0.31
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
DPP7 Q9UHL4 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
SCHEMBL5479824 0.75 DDB1 (0.40) DDB1CRBN
SCHEMBL739596 0.74 PSEN1 (0.41) DDB1CRBNDPP4DPP8DPP9
SCHEMBL29157521 0.72 DDB1 (0.55) DDB1CRBNDPP4DPP8DPP9
SCHEMBL1717738 0.69 DDB1 (0.39) DDB1CRBN
SCHEMBL4630809 0.68 DRD2 (0.33)
SCHEMBL6229055 0.67 GAA (0.41) DDB1CRBN
SCHEMBL1240861 0.67 EPHX2 (0.39)
SCHEMBL9408684 0.66 GAA (0.32)
SCHEMBL1242072 0.66 DDB1 (0.52) DDB1CRBN
SCHEMBL20355507 0.66 JAK3 (0.33)

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-106257976-A Human plasma kallikrein inhibitors 拜奥克里斯特制药公司 2016-12-28 CN disclosed