SCHEMBL15319795

SCHEMBL15319795

CC(O)CCc1ccccc1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
SLC6A2 P23975 2/20 0.43
SLC6A4 P31645 2/20 0.43
SLC6A3 Q01959 1/20 0.43
TYR P14679 2/20 0.42
POLQ O75417 1/20 0.42
PTGFR P43088 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
DAO P14920 1/20 0.41
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
CNR1 P21554 1/20 0.40

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
SCHEMBL8030461 0.85 SLC6A2 (0.48) IDO1HDAC1HDAC8SLC6A2SLC6A4
SCHEMBL267012 0.82 SLC6A2 (0.56) IDO1HDAC1HDAC8SLC6A2SLC6A4
SCHEMBL16534653 0.81 IDO1 (0.47) IDO1HDAC1HDAC8SLC6A2SLC6A4
SCHEMBL2426168 0.81 IDO1 (0.47) IDO1HDAC1HDAC8SLC6A2SLC6A4
SCHEMBL19481151 0.81 IDO1 (0.43) IDO1HDAC1HDAC8SLC6A2SLC6A4
SCHEMBL8418978 0.78 IDO1 (0.41) IDO1HDAC1HDAC8POLQPTGFR
SCHEMBL17329111 0.78 IDO1 (0.59) IDO1HDAC1HDAC8SLC6A2SLC6A4
SCHEMBL7401230 0.77 PPARG (0.47) IDO1HDAC1HDAC8PTGFRGAA
SCHEMBL16269252 0.76 ALDH1A1 (0.48) IDO1ALDH1A1
SCHEMBL21576141 0.76 POLQ (0.47) IDO1HDAC1HDAC8SLC6A2SLC6A4

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-2834233-A1 NEW ALPHA2 ADRENOCEPTOR AGONISTS Orion Corporation (FI) 2015-02-11 EP disclosed
WO-2013150173-A1 NEW ALPHA2 ADRENOCEPTOR AGONISTS ORION CORPORATION (FI) 2013-10-10 WO disclosed