SCHEMBL7987559

SCHEMBL7987559

CCc1nc(CBr)cn1C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
FAAH O00519 1/20 0.35
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
BCHE P06276 1/20 0.33
ACKR3 P25106 2/20 0.32
SCN3A Q9NY46 5/20 0.32
SCN9A Q15858 3/20 0.32
CKS1B P61024 1/20 0.32
SKP1 P63208 1/20 0.32
SKP2 Q13309 1/20 0.32
HTR6 P50406 1/20 0.32
SCN4A P35499 3/20 0.31
SCN5A Q14524 1/20 0.31
PDE10A Q9Y233 1/20 0.31
BUB1 O43683 1/20 0.31
GPR119 Q8TDV5 1/20 0.31
MAPKAPK2 P49137 1/20 0.31

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
SCHEMBL7987489 0.89 L3MBTL1 (0.34) L3MBTL1FAAHHSP90AA1HSP90AB1BCHE
SCHEMBL7989594 0.87 L3MBTL1 (0.36) L3MBTL1FAAHHSP90AA1HSP90AB1BCHE
SCHEMBL7986647 0.87 MEN1 (0.37) L3MBTL1FAAHHSP90AA1HSP90AB1HTR6
SCHEMBL7986418 0.85 MEN1 (0.34) L3MBTL1FAAHSCN3ASCN9AHTR6
SCHEMBL7994297 0.76 GPR119 (0.35) L3MBTL1FAAHHSP90AA1HSP90AB1BCHE
SCHEMBL7975881 0.74 MEN1 (0.35) L3MBTL1FAAHHTR6PDE10A
SCHEMBL7990760 0.73 L3MBTL1 (0.33) L3MBTL1FAAHSCN3ASCN9AHTR6
SCHEMBL15253670 0.70 BUB1 (0.39) L3MBTL1FAAHHSP90AA1HSP90AB1BCHE
SCHEMBL28746043 0.69 NR1H2 (0.35) FAAHHSP90AA1HSP90AB1BCHESCN3A
SCHEMBL8954140 0.69 L3MBTL1 (0.42) L3MBTL1FAAH

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
US-6207686-B1 FOR THERAPY OF HYPERTENSION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-03-27 US disclosed
WO-1996015109-A1 ENDOTHELIN ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-05-23 WO disclosed