SCHEMBL15412596

SCHEMBL15412596

Cc1c(-c2ccnn2-c2ccc(C#N)cc2)cn2nc(NCCO)nc2c1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.45
KDM4E B2RXH2 1/20 0.35
RAF1 P04049 2/20 0.33
BRAF P15056 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MALT1 Q9UDY8 1/20 0.33
ADORA1 P30542 1/20 0.33
FYN P06241 1/20 0.33
CYP17A1 P05093 1/20 0.33
SLC5A1 P13866 1/20 0.33
MAT2A P31153 1/20 0.32
JAK2 O60674 1/20 0.32
JAK3 P52333 1/20 0.32
CTSK P43235 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL15411823 0.96 ELANE (0.44) ELANEKDM4EMEN1KMT2AMALT1
SCHEMBL15411066 0.95 ELANE (0.44) ELANEKDM4EMEN1KMT2AMALT1
SCHEMBL15411663 0.92 ELANE (0.42) ELANEKDM4EBRAFMEN1KMT2A
SCHEMBL15411930 0.92 ELANE (0.43) ELANEKDM4EBRAFMEN1KMT2A
SCHEMBL15412549 0.91 ELANE (0.45) ELANEKDM4ERAF1BRAFMEN1
SCHEMBL15434236 0.91 ELANE (0.42) ELANEKDM4EMEN1KMT2AMALT1
SCHEMBL15425438 0.90 ELANE (0.42) ELANEKDM4EMEN1KMT2AMALT1
SCHEMBL15410978 0.90 ELANE (0.42) ELANEKDM4EMEN1KMT2AMALT1
SCHEMBL15411002 0.90 ELANE (0.40) ELANEKDM4EBRAFMEN1KMT2A
SCHEMBL15412213 0.90 ELANE (0.41) ELANEKDM4EBRAFMEN1KMT2A

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-2872509-B1 INHIBITION OF ENZYMES CHIESI FARMA SPA (IT) 2016-09-14 EP claimed
US-9199984-B2 Inhibition of enzymes CHIESI FARMACEUTICI S.P.A. (IT) 2015-12-01 US claimed
EP-2872509-A1 INHIBITION OF ENZYMES Chiesi Farmaceutici S.p.A. (IT) 2015-05-20 EP claimed
US-20140018345-A1 INHIBITION OF ENZYMES CHIESI FARMACEUTICI S.P.A (IT) 2014-01-16 US claimed
WO-2014009425-A1 INHIBITION OF ENZYMES CHIESI FARMACEUTICI S.P.A. (IT) 2014-01-16 WO claimed
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
WO-2014009425-A1 INHIBITION OF ENZYMES CHIESI FARMACEUTICI S.P.A. (IT) 2014-01-16 WO 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

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 2/4885KDM4E 3554/4885RAF1 2304/4885

“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.