SCHEMBL7987489

SCHEMBL7987489

CCCc1nc(CBr)cn1C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.34
PDE10A Q9Y233 1/20 0.34
HTR6 P50406 1/20 0.33
FAAH O00519 1/20 0.33
GPR119 Q8TDV5 2/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPKAPK2 P49137 2/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
BCHE P06276 1/20 0.31
SCN3A Q9NY46 3/20 0.31
SCN9A Q15858 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CKS1B P61024 1/20 0.31
SKP1 P63208 1/20 0.31
SKP2 Q13309 1/20 0.31
SREBF2 Q12772 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
SCHEMBL7986647 0.92 MEN1 (0.37) L3MBTL1PDE10AHTR6FAAHMEN1
SCHEMBL7986418 0.91 MEN1 (0.34) L3MBTL1PDE10AHTR6FAAHMEN1
SCHEMBL7987559 0.89 L3MBTL1 (0.36) L3MBTL1PDE10AHTR6FAAHGPR119
SCHEMBL7994297 0.88 GPR119 (0.35) L3MBTL1PDE10AHTR6FAAHGPR119
SCHEMBL7975881 0.80 MEN1 (0.35) L3MBTL1PDE10AHTR6FAAHMEN1
SCHEMBL7990760 0.79 L3MBTL1 (0.33) L3MBTL1PDE10AHTR6FAAHGPR119
SCHEMBL7989594 0.76 L3MBTL1 (0.36) L3MBTL1HTR6FAAHGPR119MEN1
SCHEMBL8954140 0.74 L3MBTL1 (0.42) L3MBTL1FAAHMEN1POLBMAPT
SCHEMBL28746043 0.73 NR1H2 (0.35) PDE10AHTR6FAAHGPR119MEN1
SCHEMBL7987345 0.71 L3MBTL1 (0.33) L3MBTL1PDE10AHTR6FAAHMEN1

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