SCHEMBL3363545

SCHEMBL3363545

C[SiH2]OC(O[SiH2]C)C(C)(C)CCOc1ccc(Cl)c(F)c1C=O

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.36
HTR2C P28335 5/20 0.36
GAA P10253 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ADRB2 P07550 1/20 0.30
ADRB1 P08588 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
SCHEMBL3363120 0.77 KDM4E (0.42) GAAL3MBTL1
SCHEMBL30958030 0.72 TACR2 (0.40) GAATDP1L3MBTL1
SCHEMBL3363464 0.72 CA12 (0.37) HTR2AHTR2CGAATDP1L3MBTL1
SCHEMBL3364136 0.71 ALDH1A1 (0.33)
SCHEMBL5644897 0.70 CLCN2 (0.38) HTR2AHTR2CGAATDP1L3MBTL1
SCHEMBL3366444 0.69 ESR2 (0.33)
SCHEMBL275497 0.68 ERN1 (0.42) HTR2AHTR2CGAATDP1
SCHEMBL31395445 0.68 ERN1 (0.42) HTR2AHTR2CGAATDP1
SCHEMBL31162886 0.66 ALOX5AP (0.34) HTR2AHTR2CGAATDP1L3MBTL1
SCHEMBL16974798 0.65 DRD1 (0.37) GAATDP1L3MBTL1

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
EP-1996590-B1 SPIROINDOLINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-10-06 EP disclosed