SCHEMBL7440440

SCHEMBL7440440

COC(Cn1c(-c2ccc(F)cc2)ccc(NC(=O)OCc2ccccc2)c1=O)OC

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ELANE P08246 19/20 0.55
CTRC Q99895 3/20 0.55
MGLL Q99685 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
SCHEMBL6282557 0.93 ELANE (0.59) ELANECTRC
SCHEMBL8536676 0.85 ELANE (0.59) ELANECTRCMGLL
SCHEMBL7289416 0.84 ELANE (0.64) ELANECTRC
SCHEMBL7446091 0.83 ELANE (0.53) ELANECTRCMGLL
SCHEMBL7277028 0.82 ELANE (0.46) ELANECTRC
SCHEMBL7274678 0.82 HDAC3 (0.49) ELANECTRC
SCHEMBL7276488 0.77 ELANE (0.64) ELANECTRC
SCHEMBL6086170 0.77 ELANE (0.62) ELANECTRC
SCHEMBL7442027 0.76 ELANE (0.64) ELANECTRC
SCHEMBL6557643 0.75 ELANE (0.64) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0636142-B1 LACTAM PEPTIDES HAVING HLE INHIBITING ACTIVITY ZENECA LTD (GB) 1998-06-17 EP disclosed
US-5721222-A Heterocyclic ketones ZENECA LIMITED (GB) 1998-02-24 US disclosed
US-5486529-A Certain pyridyl ketones for treating diseases involving leukocyte elastase ZENECA LIMITED (GB) 1996-01-23 US disclosed
EP-0636142-A1 LACTAM PEPTIDES HAVING HLE INHIBITING ACTIVITY ZENECA LIMITED (GB) 1995-02-01 EP disclosed
WO-1993021209-A1 LACTAM PEPTIDES HAVING HLE INHIBITING ACTIVITY ZENECA LIMITED (GB) 1993-10-28 WO disclosed