SCHEMBL1711933

SCHEMBL1711933

C=CCOC(C=O)c1ccc(F)cc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 4/20 0.35
DRD3 P35462 1/20 0.35
IDO1 P14902 2/20 0.33
TDO2 P48775 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SLC6A4 P31645 3/20 0.33
SLC6A3 Q01959 2/20 0.33
ALDH1A1 P00352 1/20 0.33
TGM2 P21980 1/20 0.33
CHRM1 P11229 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL1712648 0.83 TSHR (0.39) IDO1TDO2MEN1KMT2ASMN1; SMN2
SCHEMBL1712731 0.82 MEN1 (0.41) MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL20495054 0.76 MEN1 (0.34) SLC6A2IDO1TDO2MEN1KMT2A
SCHEMBL503318 0.75 NR3C1 (0.38) SLC6A2DRD3IDO1TDO2MEN1
SCHEMBL6388936 0.73 HPGD (0.37) MEN1KMT2ASMN1; SMN2
SCHEMBL5256023 0.72 AOC3 (0.41) IDO1TDO2ALDH1A1
SCHEMBL1711981 0.71 ACP3 (0.36) IDO1MEN1KMT2AALDH1A1
SCHEMBL933449 0.69 ALDH1A1 (0.33) MEN1KMT2AALDH1A1
SCHEMBL1906076 0.67 MEN1 (0.44) MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL4731665 0.67 ALDH1A1 (0.37) IDO1TDO2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344460-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS Galapagos N.V. (BE) 2011-07-20 EP disclosed
WO-2010029119-A1 NOVEL IMIDAZOLIDINE COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS GALAPAGOS NV (BE) 2010-03-18 WO disclosed