SCHEMBL6558378

SCHEMBL6558378

Cc1ccccc1-c1ncc(NC(=O)OCc2ccccc2)c(=O)n1CC=O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
ELANE P08246 15/20 0.50
P2RX3 P56373 1/20 0.44
CASP3 P42574 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL6555957 0.88 ELANE (0.56) NPC1RAB9AELANEP2RX3
SCHEMBL6085892 0.88 ELANE (0.60) NPC1RAB9AELANEP2RX3
SCHEMBL6556321 0.87 NPC1 (0.53) NPC1RAB9AELANEP2RX3CASP3
SCHEMBL6556109 0.87 ELANE (0.51) NPC1RAB9AELANEP2RX3
SCHEMBL6558401 0.86 ELANE (0.56) NPC1RAB9AELANEP2RX3
SCHEMBL6558347 0.85 ELANE (0.58) NPC1RAB9AELANEP2RX3
SCHEMBL6557626 0.84 ELANE (0.54) NPC1RAB9AELANEP2RX3
SCHEMBL6558418 0.84 ELANE (0.64) NPC1RAB9AELANEP2RX3
SCHEMBL6556223 0.83 ELANE (0.62) NPC1RAB9AELANEP2RX3
SCHEMBL6558159 0.83 ELANE (0.63) ELANE

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1188401-C Heterocyclic amide compound and its pharmaceutical use MITSUBISHI PHARMACEUTICAL CO L (JP) 2005-02-09 CN disclosed
EP-0826671-B1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP disclosed
CN-1131210-C Heterocyclic amide compound and medical use thereof MITSUBISHI SEIYAKU CO LTD (JP) 2003-12-17 CN disclosed
CN-1304931-A Heterocyclic amide compound and medical use thereof EFUKU CO LTD (JP) 2001-07-25 CN disclosed
US-5948785-A USEFUL AS CHYMASE INHIBITORS AND CAN BE EFFECTIVE FOR THE PROPHYLAXIS AND TREATMENT OF VARIOUS DISEASES CAUSED BY CHYMASE, SUCH AS THOSE CAUSED BY ANGIOTENSIN II. THE GREEN CROSS CORPORATION (JP) 1999-09-07 US disclosed
CN-1188472-A Heterocyclic amide compound and medical use thereof GREEN CROSS CORP (JP) 1998-07-22 CN disclosed
EP-0826671-A1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME THE GREEN CROSS CORPORATION (JP) 1998-03-04 EP disclosed