SCHEMBL8536676

SCHEMBL8536676

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

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 18/20 0.59
CTRC Q99895 3/20 0.59
MGLL Q99685 1/20 0.51
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
ALOX15 P16050 1/20 0.47
APEX1 P27695 1/20 0.47
HSD17B10 Q99714 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
SCHEMBL7276488 0.92 ELANE (0.64) ELANECTRC
SCHEMBL7446091 0.88 ELANE (0.53) ELANECTRCMGLL
SCHEMBL7440440 0.85 ELANE (0.55) ELANECTRCMGLL
SCHEMBL6557728 0.85 ELANE (0.70) ELANEMGLL
SCHEMBL7282342 0.82 ELANE (0.68) ELANECTRC
SCHEMBL8536815 0.81 ELANE (0.67) ELANECTRC
SCHEMBL7442027 0.80 ELANE (0.64) ELANECTRC
SCHEMBL7276853 0.80 HDAC3 (0.53) ELANECTRCKDM4EALDH1A1APEX1
SCHEMBL7283124 0.80 ELANE (0.49) ELANECTRCHSD17B10
SCHEMBL21685578 0.80 NPC1 (0.50) 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-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