SCHEMBL6558428

SCHEMBL6558428

O=C(Cn1cccc(NC(=O)OCc2ccccc2)c1=O)NC(Cc1ccccc1)C(O)C(F)(F)F

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ELANE P08246 19/20 0.68
CTRC Q99895 4/20 0.51
IL1RN P18510 1/20 0.47
ERAP2 Q6P179 1/20 0.47
ERAP1 Q9NZ08 1/20 0.47

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
SCHEMBL6557541 0.93 ELANE (0.62) ELANECTRCIL1RNERAP2ERAP1
SCHEMBL6557708 0.90 ELANE (0.59) ELANECTRC
SCHEMBL7282953 0.87 ELANE (0.73) ELANECTRCIL1RNERAP2ERAP1
SCHEMBL6558269 0.86 ELANE (0.51) ELANECTRC
SCHEMBL6556283 0.86 ELANE (0.70) ELANECTRC
SCHEMBL8401390 0.86 ELANE (0.70) ELANECTRC
SCHEMBL6558302 0.85 ELANE (0.76) ELANECTRC
SCHEMBL6556548 0.85 ELANE (0.61) ELANECTRCIL1RNERAP2ERAP1
SCHEMBL6556080 0.83 ELANE (0.69) ELANECTRC
SCHEMBL6558141 0.81 ELANE (0.69) ELANECTRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0826671-B1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME MITSUBISHI PHARMA CORP (JP) 2004-12-29 EP 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
EP-0826671-A1 HETEROCYCLIC AMIDE COMPOUNDS AND MEDICINAL USE OF THE SAME THE GREEN CROSS CORPORATION (JP) 1998-03-04 EP disclosed