SCHEMBL27952999

SCHEMBL27952999

[CH2]c1ccccc1C(=O)Nc1cccc(CN)c1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 1/20 0.56
PLG P00747 2/20 0.49
KLK1 P06870 2/20 0.49
KLK6 Q92876 2/20 0.49
CFD P00746 1/20 0.49
KLKB1 P03952 1/20 0.48
TERT O14746 1/20 0.48
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALOX15 P16050 1/20 0.45

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
SCHEMBL17538569 0.84 ALDH1A1 (0.63) AURKBPLGKLK1KLK6CFD
SCHEMBL27484183 0.84 FADS1 (0.60) AURKBPLGKLK1KLK6CFD
SCHEMBL23367948 0.83 SMN1; SMN2 (0.68) AURKBALDH1A1SMN1; SMN2
SCHEMBL27795055 0.82 PLG (0.60) AURKBPLGKLK1KLK6
SCHEMBL6681834 0.79 KCNK3 (0.69) CFD
SCHEMBL94334 0.78 ALDH1A1 (0.66) ALDH1A1
SCHEMBL2304215 0.78 MEN1 (0.70) ALDH1A1
SCHEMBL2308674 0.78 FADS1 (0.70) ALDH1A1SMN1; SMN2
SCHEMBL28135448 0.77 KCNMA1 (0.41) PLGKLK1KLK6CFDKLKB1
SCHEMBL17976484 0.75 CFD (0.60) CFDSMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103664973-A Spiro-oxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC 2014-03-26 CN claimed
CN-106928247-A Spiral shell oxindole compounds and its purposes as therapeutic agent 泽农医药公司 2017-07-07 CN disclosed
CN-103664973-B Spiro-oxindole compounds and their use as therapeutic agents 泽农医药公司 2017-04-19 CN disclosed
CN-102256983-B Spirooxindole compounds and their use as therapeutic agents 泽农医药公司 2017-04-05 CN disclosed
CN-103664973-A Spiro-oxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC 2014-03-26 CN disclosed