SCHEMBL4137643

SCHEMBL4137643

Cc1c(I)cc(C(=O)NC2CC2)c(=O)n1-c1cccc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.50
PDE4D Q08499 1/20 0.50
NOTUM Q6P988 1/20 0.47
ELANE P08246 9/20 0.46
NPC1 O15118 1/20 0.44
TP53 P04637 1/20 0.44
HPGD P15428 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CNR2 P34972 1/20 0.42
DRD4 P21917 1/20 0.41
CRHR1 P34998 3/20 0.41

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
SCHEMBL2272178 0.86 ELANE (0.56) NOTUMELANESMN1; SMN2
SCHEMBL984085 0.82 NOTUM (0.64) NOTUMELANEKMT2A
SCHEMBL8053624 0.82 ELANE (0.49) NOTUMELANESMN1; SMN2
SCHEMBL8229059 0.82 NOTUM (0.51) NOTUMELANETP53MEN1KMT2A
SCHEMBL4152986 0.82 ELANE (0.50) NOTUMELANE
SCHEMBL27716691 0.82 NOTUM (0.53) NOTUMELANEHPGDMEN1KMT2A
SCHEMBL5758047 0.81 ELANE (0.56) PDE4BPDE4DNOTUMELANENPC1
SCHEMBL1604233 0.81 KDM4E (0.49) NOTUMELANESMN1; SMN2
SCHEMBL5758051 0.80 ELANE (0.58) PDE4BPDE4DNOTUMELANENPC1
SCHEMBL4281376 0.80 PDE4B (0.43) PDE4BPDE4DNOTUMELANENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105239-A1 2-PYRIDINE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2009-04-23 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-20090105239-A1 2-PYRIDINE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE SERPINB1, ELANE, MPO PDE4B 348/4885PDE4D 487/4885NOTUM 2654/4885

“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.