SCHEMBL28024375

SCHEMBL28024375

N#Cc1nc2cc(F)ccc2o1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB8 P28062 4/20 0.65
PSMB5 P28074 2/20 0.51
MPO P05164 1/20 0.42
GABRP O00591 3/20 0.38
GABRD O14764 3/20 0.38
GABRA1 P14867 3/20 0.38
GABRB1 P18505 3/20 0.38
GABRG2 P18507 3/20 0.38
GABRB3 P28472 3/20 0.38
GABRA5 P31644 3/20 0.38
GABRA3 P34903 3/20 0.38
GABRA2 P47869 3/20 0.38
GABRB2 P47870 3/20 0.38
GABRA4 P48169 3/20 0.38
GABRE P78334 3/20 0.38
GABRA6 Q16445 3/20 0.38
GABRG1 Q8N1C3 3/20 0.38
GABRG3 Q99928 3/20 0.38
GABRQ Q9UN88 3/20 0.38
DAGLA Q9Y4D2 1/20 0.36

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
SCHEMBL9797527 0.78 PSMB8 (0.63) PSMB8PSMB5LMNACYP1A2MAPT
SCHEMBL19899630 0.77 PSMB8 (0.40) PSMB8MPOMAPTFBP1
SCHEMBL9797235 0.77 PSMB8 (0.61) PSMB8PSMB5LMNACYP1A2MAPT
SCHEMBL12965896 0.76 LMNA (0.61) MPOGABRPGABRDGABRA1GABRB1
SCHEMBL31119203 0.76 LMNA (0.61) MPOGABRPGABRDGABRA1GABRB1
SCHEMBL30058638 0.75 PSMB8 (0.59) PSMB8PSMB5MAPTALOX15KDM4E
SCHEMBL9757389 0.75 PSMB8 (0.59) PSMB8PSMB5LMNACYP1A2MAPT
SCHEMBL548913 0.73 PSMB8 (1.00) PSMB8PSMB5LMNACYP1A2MAPT
SCHEMBL5547324 0.72 MPO (0.45) MPOGABRPGABRDGABRA1GABRB1
SCHEMBL3095143 0.72 MPO (0.45) PSMB8MPOGABRPGABRDGABRA1

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
CN-104725331-A Method for preparing 5-fluorobenzo[d]oxazole-2-nitrile CHANGSHA SHENCHENG BIOLOG TECHNOLOGY CO LTD 2015-06-24 CN disclosed
CN-104725331-A Method for preparing 5-fluorobenzo[d]oxazole-2-nitrile CHANGSHA SHENCHENG BIOLOG TECHNOLOGY CO LTD 2015-06-24 CN disclosed