SCHEMBL6744559

SCHEMBL6744559

CC(C)C(C(=O)C(F)(F)C(F)(F)F)N1CCCCC1C(=O)NC(=O)[C@@H](NC(=O)c1ccc(C(=O)N2CCOCC2)cc1)C(C)C

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ELANE P08246 11/20 0.58
CTSG P08311 1/20 0.41
MLYCD O95822 1/20 0.39
EPHX2 P34913 1/20 0.36
MALT1 Q9UDY8 1/20 0.35
L3MBTL3 Q96JM7 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NR3C1 P04150 1/20 0.35
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34

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
SCHEMBL7370365 0.98 ELANE (0.60) ELANECTSGMLYCDEPHX2MALT1
SCHEMBL7339336 0.95 ELANE (0.64) ELANECTSGMLYCDEPHX2MALT1
SCHEMBL7963862 0.95 ELANE (0.58) ELANECTSGMLYCDEPHX2MALT1
SCHEMBL8430121 0.95 ELANE (0.61) ELANECTSGMLYCDEPHX2MALT1
SCHEMBL7861404 0.91 ELANE (0.59) ELANECTSGMLYCDEPHX2MALT1
SCHEMBL7960490 0.89 ELANE (0.51) ELANECTSGMALT1L3MBTL3L3MBTL1
SCHEMBL7964090 0.89 ELANE (0.51) ELANECTSGMLYCDKMT2A
SCHEMBL7278895 0.85 KMT2A (0.50) ELANECTSGL3MBTL1KMT2A
SCHEMBL7952508 0.85 ELANE (0.48) ELANECTSGKMT2A
SCHEMBL7962916 0.85 ELANE (0.49) ELANECTSGMLYCD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030096759-A1 Novel elastase inhibitors AVENTISUB II INC. 2003-05-22 US claimed
EP-0804465-A1 NOVEL ELASTASE INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-11-05 EP claimed
WO-1995033763-A1 NOVEL ELASTASE INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1995-12-14 WO claimed
US-6693072-B2 Elastase inhibitors AVENTIS PHARMACEUTICALS INC. 2004-02-17 US disclosed
EP-0804465-B1 NOVEL ELASTASE INHIBITORS AVENTIS PHARMA INC (US) 2003-08-06 EP disclosed
US-20030096759-A1 Novel elastase inhibitors AVENTISUB II INC. 2003-05-22 US disclosed
EP-0804465-A1 NOVEL ELASTASE INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1997-11-05 EP disclosed
WO-1995033763-A1 NOVEL ELASTASE INHIBITORS HOECHST MARION ROUSSEL, INC. (US) 1995-12-14 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030096759-A1 Novel elastase inhibitors ELANE, SERPINB1, MMP8 ELANE 1/4885CTSG 91/4885MLYCD 4364/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.