SCHEMBL8987971

SCHEMBL8987971

CC(=O)N1[C@H](C)CN(c2cccc(C3CNc4ncc(Cl)cc43)n2)C[C@@H]1C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EIF2AK4 Q9P2K8 4/20 0.40
HSD11B1 P28845 3/20 0.38
CACNA1G O43497 1/20 0.36
CACNA1H O95180 1/20 0.36
CACNA1I Q9P0X4 1/20 0.36
SLC6A7 Q99884 1/20 0.36
SORD Q00796 3/20 0.35
PIK3CD O00329 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
WNT3A P56704 1/20 0.31
SCN9A Q15858 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
SCHEMBL13933293 0.90 EIF2AK4 (0.39) EIF2AK4HSD11B1SLC6A7SORDPIK3CD
SCHEMBL8985979 0.88 EIF2AK4 (0.38) EIF2AK4HSD11B1SORDPIK3CDSCN9A
SCHEMBL8987864 0.86 EIF2AK4 (0.38) EIF2AK4HSD11B1SLC6A7SORD
SCHEMBL12341821 0.86 EIF2AK4 (0.37) EIF2AK4HSD11B1SORD
SCHEMBL8987784 0.85 EIF2AK4 (0.38) EIF2AK4HSD11B1CACNA1GCACNA1HCACNA1I
SCHEMBL8989305 0.85 HSD11B1 (0.40) EIF2AK4HSD11B1CACNA1GCACNA1HCACNA1I
SCHEMBL8990242 0.85 EIF2AK4 (0.37) EIF2AK4HSD11B1SLC6A7
SCHEMBL8990365 0.84 EIF2AK4 (0.36) EIF2AK4HSD11B1SORDHCAR2WNT3A
SCHEMBL8988012 0.84 JAK3 (0.38) EIF2AK4WNT3A
SCHEMBL8987899 0.83 PIK3CD (0.38) EIF2AK4HSD11B1CACNA1GCACNA1HCACNA1I

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188281-B2 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-05-29 US disclosed
US-20090176763-A1 Azaindoles useful as inhibitors of JAK and other protein kinases VERTEX PHARMACEUTICALS INCORPORATED 2009-07-09 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-20090176763-A1 Azaindoles useful as inhibitors of JAK and other protein kinases JAK3, JAK2, JAK1 EIF2AK4 462/4885HSD11B1 4216/4885CACNA1G 4851/4885

“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.