SCHEMBL19639985

SCHEMBL19639985

Cn1c(-c2ccnn2-c2ccc(C#N)cc2)c(C(=O)O)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ELANE P08246 13/20 0.56
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CTSK P43235 5/20 0.41
CYP2C9 P11712 4/20 0.40
CYP3A4 P08684 3/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL19684694 0.93 ELANE (0.56) ELANEMEN1KMT2ACTSKCYP2C9
SCHEMBL21796123 0.90 ELANE (0.54) ELANEMEN1KMT2ACTSKCYP2C9
SCHEMBL19640024 0.89 ELANE (0.54) ELANEMEN1KMT2ACYP2C9CYP3A4
SCHEMBL19640000 0.89 ELANE (0.56) ELANEMEN1KMT2ACTSKCYP3A4
SCHEMBL19640104 0.87 ELANE (0.54) ELANEMEN1KMT2ACTSK
Benzene SCHEMBL19639991 0.86 ELANE (0.54) ELANEMEN1KMT2ACTSK
SCHEMBL19656233 0.86 ELANE (0.53) ELANEMEN1KMT2ACTSK
SCHEMBL19639792 0.85 ELANE (0.46) ELANECTSKCYP2C9CYP3A4POLB
SCHEMBL21796119 0.85 ELANE (0.54) ELANEMEN1KMT2ACTSK
SCHEMBL19656241 0.85 ELANE (0.52) ELANEMEN1KMT2ACTSKCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3464268-B1 NOVEL COMPOUNDS CHIESI FARM SPA (IT) 2020-03-11 EP claimed
EP-3464268-A1 NOVEL COMPOUNDS Chiesi Farmaceutici S.p.A. (IT) 2019-04-10 EP claimed
US-10172830-B2 Pyrazolone compounds having human neutrophil elastase inhibitory properties CHIESI FARMACEUTICI S.P.A. (IT) 2019-01-08 US claimed
WO-2017207432-A1 NOVEL COMPOUNDS CHIESI FARMACEUTICI S.P.A. (IT) 2017-12-07 WO claimed
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 2/4885MEN1 4540/4885KMT2A 4327/4885
US-10172830-B2 Pyrazolone compounds having human neutrophil elastase inhibitory properties SERPINB1, ELANE, EPX ELANE 2/4885MEN1 4112/4885KMT2A 4207/4885

“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.