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SCHEMBL15411682

SCHEMBL15411682

Cc1c(-c2ccnn2-c2ccc(C#N)cc2)cn2nc(NC(=O)CCNC(=N)N)nc2c1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 5/20 0.43
▸ ADORA2A P29274 1/20 0.35
▸ MALT1 Q9UDY8 1/20 0.35
▸ SLC5A1 P13866 4/20 0.33
▸ CTSK P43235 2/20 0.32
▸ KCNH2 Q12809 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ CETP P11597 1/20 0.32
▸ EPHX2 P34913 2/20 0.32
▸ PTGS2 P35354 2/20 0.32
▸ ITGB3 P05106 1/20 0.31
▸ ITGA2B P08514 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CTSL P07711 1/20 0.31
▸ CTSB P07858 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CTSS P25774 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ MAT2A P31153 1/20 0.31

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
SCHEMBL15411530 0.92 ELANE (0.45) ELANEADORA2AMALT1SLC5A1CTSK
SCHEMBL15411725 0.90 ELANE (0.46) ELANEADORA2AMALT1SLC5A1KDM4E
SCHEMBL15412243 0.90 ELANE (0.47) ELANEADORA2AMALT1SLC5A1KDM4E
SCHEMBL15411098 0.90 ELANE (0.46) ELANEADORA2AMALT1SLC5A1CTSK
SCHEMBL15411585 0.89 ELANE (0.46) ELANEADORA2AMALT1SLC5A1CTSK
SCHEMBL15412588 0.89 ELANE (0.45) ELANEADORA2AMALT1SLC5A1CTSK
SCHEMBL15410997 0.89 ELANE (0.45) ELANEADORA2AMALT1SLC5A1KDM4E
SCHEMBL15411159 0.89 ELANE (0.45) ELANEADORA2AMALT1SLC5A1CETP
SCHEMBL15425389 0.88 ELANE (0.44) ELANEADORA2AMALT1SLC5A1KDM4E
SCHEMBL15411170 0.88 ELANE (0.44) ELANEADORA2AMALT1SLC5A1EPHX2

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
EP-2872509-B1 INHIBITION OF ENZYMES CHIESI FARMA SPA (IT) 2016-09-14 — — EP disclosed
EP-2872509-B1 INHIBITION OF ENZYMES CHIESI FARMA SPA (IT) 2016-09-14 — — EP disclosed
US-9199984-B2 Inhibition of enzymes CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-01 — — US disclosed
US-9199984-B2 Inhibition of enzymes CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-01 — — US disclosed
US-9199984-B2 Inhibition of enzymes CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-01 — — US disclosed
EP-2872509-A1 INHIBITION OF ENZYMES Chiesi Farmaceutici S.p.A. (IT) 2015-05-20 — — EP disclosed
US-20140018345-A1 INHIBITION OF ENZYMES CHIESI FARMACEUTICI S.P.A (IT) 2014-01-16 — — US disclosed
US-20140018345-A1 INHIBITION OF ENZYMES CHIESI FARMACEUTICI S.P.A (IT) 2014-01-16 — — US disclosed
US-20140018345-A1 INHIBITION OF ENZYMES CHIESI FARMACEUTICI S.P.A (IT) 2014-01-16 — — US disclosed
WO-2014009425-A1 INHIBITION OF ENZYMES CHIESI FARMACEUTICI S.P.A. (IT) 2014-01-16 — — 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-20140018345-A1 INHIBITION OF ENZYMES SERPINB1, ELANE, MPO ELANE 2/4885ADORA2A 1511/4885MALT1 4442/4885

“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.