SCHEMBL103483

SCHEMBL103483

C/C=C\c1cc(C(=O)Oc2c(F)c(F)c(F)c(F)c2F)ccc1N1CCN(CCOCc2ccccc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 1/20 0.42
DRD2 P14416 12/20 0.41
DRD4 P21917 12/20 0.41
DRD3 P35462 12/20 0.41
TEAD3 Q99594 1/20 0.41
PRMT1 Q99873 1/20 0.39
GRM5 P41594 2/20 0.38
BCHE P06276 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL102932 0.88 DRD2 (0.47) MEN1GAAKMT2ADRD2DRD4
SCHEMBL102930 0.88 DRD2 (0.47) MEN1GAAKMT2ADRD2DRD4
SCHEMBL103640 0.87 MEN1 (0.47) MEN1GAAKMT2ADRD2DRD4
SCHEMBL103639 0.87 MEN1 (0.47) MEN1GAAKMT2ADRD2DRD4
SCHEMBL106059 0.79 L3MBTL1 (0.37) MEN1KMT2ALMNAMAPT
SCHEMBL106060 0.79 L3MBTL1 (0.37) MEN1KMT2ALMNAMAPT
SCHEMBL103214 0.79 PRMT1 (0.38) DRD2PRMT1MAPT
SCHEMBL103212 0.79 PRMT1 (0.38) DRD2PRMT1MAPT
SCHEMBL102207 0.77 MEN1 (0.47) MEN1GAAKMT2ADRD2DRD4
SCHEMBL102543 0.77 MEN1 (0.47) MEN1GAAKMT2ADRD2DRD4

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-2426113-A1 CARBINOL COMPOUND HAVING HETEROCYCLIC LINKER Kowa Company, Ltd. (JP) 2012-03-07 EP disclosed