SCHEMBL7301228

SCHEMBL7301228

NC(=NO)c1ccc(OCc2cccc(Cl)c2)cc1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.66
RXRB P28702 1/20 0.66
RXRG P48443 1/20 0.66
MAOB P27338 5/20 0.64
MAOA P21397 2/20 0.64
DHFR P00374 1/20 0.56
F2 P00734 2/20 0.56
NR4A2 P43354 1/20 0.53
ALOX5 P09917 1/20 0.52
GRIN2B Q13224 1/20 0.51

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
SCHEMBL16697339 0.84 NR4A2 (0.60) MAOBMAOADHFRF2NR4A2
SCHEMBL16697343 0.84 NR4A2 (0.60) MAOBMAOADHFRF2NR4A2
SCHEMBL7301072 0.83 PARP10 (0.66) MAOBMAOAF2NR4A2
SCHEMBL3624161 0.80 MAOB (0.73) RXRARXRBRXRGMAOBMAOA
SCHEMBL29784197 0.79 RXRA (1.00) RXRARXRBRXRGMAOBMAOA
SCHEMBL6522344 0.79 RXRA (1.00) RXRARXRBRXRGMAOBMAOA
SCHEMBL1680762 0.79 MAOB (1.00) RXRARXRBRXRGMAOBMAOA
SCHEMBL9627120 0.79 MAOB (0.76) RXRARXRBRXRGMAOBMAOA
SCHEMBL8378348 0.78 F2 (0.51) RXRARXRBRXRGMAOBF2
SCHEMBL8378347 0.78 F2 (0.51) RXRARXRBRXRGMAOBF2

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
EP-0504574-B1 1,2,4-Oxadiazole derivatives having monoamine oxidase B enzyme-inhibitory activity and method for preparing same WAKAMOTO PHARMA CO LTD (JP) 1996-02-28 EP claimed
EP-0504574-A1 1,2,4-Oxadiazole derivatives having monoamine oxidase B enzyme-inhibitory activity and method for preparing same Wakamoto Pharmaceutical Co., Ltd. (JP) 1992-09-23 EP claimed
EP-0504574-B1 1,2,4-Oxadiazole derivatives having monoamine oxidase B enzyme-inhibitory activity and method for preparing same WAKAMOTO PHARMA CO LTD (JP) 1996-02-28 EP disclosed
US-5356916-A Treating Parkinson*s disease WAKAMOTO PHARMACEUTICAL CO., LTD. (JP) 1994-10-18 US disclosed
EP-0504574-A1 1,2,4-Oxadiazole derivatives having monoamine oxidase B enzyme-inhibitory activity and method for preparing same Wakamoto Pharmaceutical Co., Ltd. (JP) 1992-09-23 EP disclosed