SCHEMBL15412416

SCHEMBL15412416

Cc1c(-c2ncnn2-c2ccc(C#N)cc2)cn2nc(NC(=O)CCCN(C)C)nc2c1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 1/20 0.35
ELANE P08246 8/20 0.35
MGAT2 Q10469 1/20 0.34
CTSK P43235 2/20 0.34
ADORA2A P29274 1/20 0.34
CCR2 P41597 1/20 0.33
RAD52 P43351 3/20 0.32
PAX8 Q06710 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
LRRK2 Q5S007 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
SCHEMBL15412140 0.97 MALT1 (0.36) MALT1ELANEMGAT2CTSKADORA2A
SCHEMBL15412590 0.93 ELANE (0.34) MALT1ELANEMGAT2CTSKADORA2A
SCHEMBL15425572 0.91 ELANE (0.36) MALT1ELANEMGAT2ADORA2ACCR2
Bromide SCHEMBL15411927 0.91 ELANE (0.36) MALT1ELANEMGAT2ADORA2ACCR2
SCHEMBL15412357 0.90 ELANE (0.44) MALT1ELANECTSKADORA2A
SCHEMBL18075876 0.89 KMT2A (0.40) MALT1ELANEMGAT2CTSKADORA2A
SCHEMBL18076215 0.88 MALT1 (0.37) MALT1ELANECTSKADORA2ARXFP1
SCHEMBL15411679 0.88 ELANE (0.38) MALT1ELANEADORA2ALRRK2
SCHEMBL15425550 0.87 ELANE (0.33) MALT1ELANEMGAT2ADORA2A
Formic Acid SCHEMBL15411887 0.85 ELANE (0.32) MALT1ELANEMGAT2ADORA2A

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
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

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 MALT1 4442/4885ELANE 2/4885MGAT2 1515/4885

“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.