SCHEMBL19639996

SCHEMBL19639996

CCOC(=O)c1c(-c2ccnn2-c2ccc(C#N)cc2)n(CC)n(-c2cccc(C(F)(F)F)c2)c1=O

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 18/20 0.54
CYP2C9 P11712 3/20 0.48
CYP3A4 P08684 2/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL19640024 0.92 ELANE (0.54) ELANECYP2C9CYP3A4MEN1KMT2A
SCHEMBL21796123 0.90 ELANE (0.54) ELANECYP2C9CYP3A4MEN1KMT2A
SCHEMBL19639807 0.81 ELANE (0.48) ELANECYP2C9CYP3A4
SCHEMBL19640000 0.81 ELANE (0.56) ELANECYP3A4MEN1KMT2A
SCHEMBL19684694 0.80 ELANE (0.56) ELANECYP2C9CYP3A4MEN1KMT2A
SCHEMBL19639985 0.80 ELANE (0.56) ELANECYP2C9CYP3A4MEN1KMT2A
SCHEMBL19639759 0.80 ELANE (0.49) ELANECYP2C9
SCHEMBL19656241 0.80 ELANE (0.52) ELANECYP2C9CYP3A4MEN1KMT2A
SCHEMBL984474 0.80 ELANE (0.78) ELANECYP2C9CYP3A4
SCHEMBL19639773 0.79 ELANE (0.53) ELANECYP2C9CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170340611-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US claimed
EP-3464268-B1 NOVEL COMPOUNDS CHIESI FARM SPA (IT) 2020-03-11 EP disclosed
EP-3464268-A1 NOVEL COMPOUNDS Chiesi Farmaceutici S.p.A. (IT) 2019-04-10 EP disclosed
US-10172830-B2 Pyrazolone compounds having human neutrophil elastase inhibitory properties CHIESI FARMACEUTICI S.P.A. (IT) 2019-01-08 US disclosed
US-10172830-B2 Pyrazolone compounds having human neutrophil elastase inhibitory properties CHIESI FARMACEUTICI S.P.A. (IT) 2019-01-08 US disclosed
WO-2017207432-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-12-07 WO disclosed
WO-2017207432-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-12-07 WO disclosed
US-20170340611-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US disclosed
US-20170340611-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US disclosed
US-20170340611-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-11-30 US 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 (2 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-20170340611-A1 NOVEL COMPOUNDS SERPINB1, ELANE, MPO ELANE 2/4885CYP2C9 3005/4885CYP3A4 1599/4885
US-10172830-B2 Pyrazolone compounds having human neutrophil elastase inhibitory properties SERPINB1, ELANE, EPX ELANE 2/4885CYP2C9 2241/4885CYP3A4 1162/4885

“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.