SCHEMBL9895089

SCHEMBL9895089

CN(C)Cc1cc(OC2CCN(C(=O)O)CC2)nc(C(F)(F)F)n1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 6/20 0.41
LIPE Q05469 7/20 0.36
GPR119 Q8TDV5 3/20 0.35
DRD2 P14416 1/20 0.35
DRD3 P35462 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
LOX P28300 1/20 0.34
RBP4 P02753 1/20 0.33
TTR P02766 1/20 0.33

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
SCHEMBL6121558 0.88 LOXL2 (0.43) LOXL2LIPEGPR119DRD2DRD3
SCHEMBL6121527 0.88 GPR119 (0.48) GPR119
SCHEMBL6121938 0.86 LOXL2 (0.42) LOXL2LIPEGPR119DRD2DRD3
SCHEMBL9894420 0.85 LOXL2 (0.42) LOXL2LIPEGPR119DRD2DRD3
SCHEMBL6121322 0.84 LOXL2 (0.42) LOXL2LIPEGPR119DRD2DRD3
SCHEMBL6122245 0.83 LOXL2 (0.42) LOXL2LIPEGPR119FFAR4RBP4
SCHEMBL9894201 0.82 LOXL2 (0.42) LOXL2LIPEDRD2DRD3FFAR4
SCHEMBL6122144 0.82 LOXL2 (0.43) LOXL2LIPEDRD2DRD3FFAR4
SCHEMBL6121328 0.81 PIM1 (0.35)
SCHEMBL6122636 0.80 LOXL2 (0.42) LOXL2LIPEGPR119DRD2DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10640506-B2 Cyclobutyl substituted pyrrolopyridine and pyrrolopyrimidines derivatives as JAK inhibitors INCYTE HOLDINGS CORPORATION (US) 2020-05-05 US disclosed
US-20190135813-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINES DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION 2019-05-09 US disclosed
US-20150087632-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINES DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION (US) 2015-03-26 US disclosed
US-8933085-B2 Cyclobutyl substituted pyrrolopyridine and pyrrolopyrimidine derivatives as JAK inhibitors INCYTE CORPORATION (US) 2015-01-13 US disclosed
US-20120149681-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINE DERIVATIVES AS JAK INHIBITORS INCYTE CORPORATION 2012-06-14 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 (4 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-10640506-B2 Cyclobutyl substituted pyrrolopyridine and pyrrolopyrimidines derivatives as JAK inhibitors JAK2, JAK1, JAK3 LOXL2 920/4885LIPE 4426/4885GPR119 3392/4885
US-20120149681-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINE DERIVATIVES AS JAK INHIBITORS JAK1, JAK2, JAK3 LOXL2 809/4885LIPE 4392/4885GPR119 3176/4885
US-20150087632-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINES DERIVATIVES AS JAK INHIBITORS JAK2, JAK1, JAK3 LOXL2 920/4885LIPE 4426/4885GPR119 3392/4885
US-20190135813-A1 CYCLOBUTYL SUBSTITUTED PYRROLOPYRIDINE AND PYRROLOPYRIMIDINES DERIVATIVES AS JAK INHIBITORS JAK2, JAK1, JAK3 LOXL2 920/4885LIPE 4426/4885GPR119 3392/4885

“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.