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SCHEMBL8624804

SCHEMBL8624804

Cc1cccc(COC(=O)Nc2ccc(-c3ccccc3)n(C(C(N)=O)C(C(=O)C(F)(F)C(=O)NCCc3ccccc3)C(C)C)c2=O)n1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 20/20 0.46
▸ CTRC Q99895 4/20 0.45

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
SCHEMBL8628528 0.88 ELANE (0.45) ELANECTRC
SCHEMBL7440506 0.82 ELANE (0.68) ELANECTRC
SCHEMBL8631836 0.80 CTRC (0.34) ELANECTRC
SCHEMBL7545819 0.77 ELANE (0.58) ELANECTRC
SCHEMBL8654148 0.76 ELANE (0.41) ELANECTRC
SCHEMBL8627256 0.76 ELANE (0.47) ELANECTRC
SCHEMBL8654152 0.75 CASP1 (0.41) ELANECTRC
SCHEMBL7546824 0.74 ELANE (0.54) ELANECTRC
SCHEMBL8994541 0.72 ELANE (0.51) ELANECTRC
SCHEMBL7544232 0.72 ELANE (0.81) 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 1 patent. 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